.ALPHA.-METHYLFENTANYL

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National Institutes of Health Divider Arrow

NCATS

Details

Stereochemistry	RACEMIC
Molecular Formula	C23H30N2O
Molecular Weight	350.4971
Optical Activity	( + / - )
Defined Stereocenters	0 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of .ALPHA.-METHYLFENTANYL

Structure Search

SMILES

CCC(=O)N(C1CCN(CC1)C(C)CC2=CC=CC=C2)C3=CC=CC=C3

InChI

InChIKey=NGTVDHYUFBKWID-UHFFFAOYSA-N

InChI=1S/C23H30N2O/c1-3-23(26)25(21-12-8-5-9-13-21)22-14-16-24(17-15-22)19(2)18-20-10-6-4-7-11-20/h4-13,19,22H,3,14-18H2,1-2H3

HIDE SMILES / InChI

Molecular Formula	C23H30N2O
Molecular Weight	350.4971
Charge	0
Count

Stereochemistry	RACEMIC
Additional Stereochemistry	No
Defined Stereocenters	0 / 1
E/Z Centers	0
Optical Activity	( + / - )

Approval Year

Substance Class	Chemical Created by `admin` on `Fri Dec 15 15:43:35 GMT 2023` Edited by `admin` on `Fri Dec 15 15:43:35 GMT 2023`
Record UNII	8FU589W85C
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

.ALPHA.-METHYLFENTANYL

Common Name

English

IDS-NA-016

Code

English

(±)-.ALPHA.-METHYLFENTANYL

Common Name

English

.ALPHA.-METHYLFENTANYL [MI]

Common Name

English

N-(1-(1-METHYL-2-PHENYLETHYL)-4-PIPERIDINYL)-N-PHENYLPROPANAMIDE

Systematic Name

English

ALPHA-METHYLFENTANYL

Common Name

English

ACSCN-9814

Common Name

English

DEA NO. 9814

Code

English

METHYLFENTANYL, .ALPHA.-

Common Name

English

N-(1-(.ALPHA.-METHYLPHENETHYL)-4-PIPERIDYL)PROPIONANILIDE

Systematic Name

English

CHINA-WHITE

Common Name

English

PROPANAMIDE, N-(1-(1-METHYL-2-PHENYLETHYL)-4-PIPERIDINYL)-N-PHENYL-

Systematic Name

English

Classification Tree Code System Code

DEA NO.

9814

Created by admin on Fri Dec 15 15:43:35 GMT 2023 , Edited by admin on Fri Dec 15 15:43:35 GMT 2023

WIKIPEDIA

Designer-drugs-ą-Methylfentanyl

Created by admin on Fri Dec 15 15:43:35 GMT 2023 , Edited by admin on Fri Dec 15 15:43:35 GMT 2023

WIKIPEDIA

List_of_fentanyl_analogues

Created by admin on Fri Dec 15 15:43:35 GMT 2023 , Edited by admin on Fri Dec 15 15:43:35 GMT 2023

Code System Code Type Description

FDA UNII

8FU589W85C

Created by admin on Fri Dec 15 15:43:35 GMT 2023 , Edited by admin on Fri Dec 15 15:43:35 GMT 2023

PRIMARY

EPA CompTox

DTXSID60273955

Created by admin on Fri Dec 15 15:43:35 GMT 2023 , Edited by admin on Fri Dec 15 15:43:35 GMT 2023

PRIMARY

CHEBI

61092

Created by admin on Fri Dec 15 15:43:35 GMT 2023 , Edited by admin on Fri Dec 15 15:43:35 GMT 2023

PRIMARY

MERCK INDEX

m7415

Created by admin on Fri Dec 15 15:43:35 GMT 2023 , Edited by admin on Fri Dec 15 15:43:35 GMT 2023

PRIMARY

Merck Index

PUBCHEM

62281

Created by admin on Fri Dec 15 15:43:35 GMT 2023 , Edited by admin on Fri Dec 15 15:43:35 GMT 2023

PRIMARY

CAS

79704-88-4

Created by admin on Fri Dec 15 15:43:35 GMT 2023 , Edited by admin on Fri Dec 15 15:43:35 GMT 2023

PRIMARY

WEB RESOURCE

.ALPHA.-METHYLFENTANYL

Created by admin on Fri Dec 15 15:43:35 GMT 2023 , Edited by admin on Fri Dec 15 15:43:35 GMT 2023

PRIMARY

DRUG BANK

DB01557

Created by admin on Fri Dec 15 15:43:35 GMT 2023 , Edited by admin on Fri Dec 15 15:43:35 GMT 2023

PRIMARY

Related Record Type Details


					1PE72K8X46

MU-TYPE OPIOID RECEPTOR

TARGET -> AGONIST


					53A1U72E00

.ALPHA.-METHYLFENTANYL HYDROCHLORIDE

SALT/SOLVATE -> PARENT

Comments:

APPROXIMATE PURE ANHYDROUS DRUG CONTENT (IN PERCENT)

Amount:

Related Record Type Details


					2MK6D8JV6J

METABOLITE INACTIVE -> PARENT

Interaction Type:

MAJOR


					UEA94DK5VS

P-AROMATIC HYDROXY AND .OMEGA.-HYDROXYPROPIONYL .ALPHA.-METHYLFENTANY

METABOLITE -> PARENT

Comments:

Excreted in rat urine of metabolite p-Aromatic hydroxy and .omega.-hydroxypropionyl .alpha.-methylfentany(%):Time after the injection(0?24 h)- 0.1-0.03, limit of quantification-(24?48 h), limit of detection-(48?72 h)


					QJ2S8B2D89

PROPANAMIDE, N-(1-(2-(4-HYDROXYPHENYL)-1-METHYLETHYL)-4-PIPERIDINYL)-N-PHENYL-

METABOLITE -> PARENT

Comments:

Excreted in rat urine of metabolite P-AROMATIC HYDROXY A-METHYLFENTANYL (%):Time after the injection(0?24 h)- 1.0-0.3, (24?48 h)- 0.3-0.1; limit of detection- 48?72 h


					YXA2JN5FTQ

.OMEGA.-HYDROXYPROPIONYL .ALPHA.-METHYLFENTANYL

METABOLITE -> PARENT

Comments:

Excreted in rat urine of metabolite of .omega.-Hydroxypropionyl .alpha.-methylfentany(%):Time after the injection(0?24 h)- 0.1-0.02, limit of quantification-(24?48 h), limit of detection- (48?72 h)


					QM5WLG4LWZ

.OMEGA.-1 HYDROXYPROPIONYL .ALPHA.-METHYLFENTANYL

METABOLITE -> PARENT

Comments:

Excreted in rat urine of metabolite of .omega.-1 Hydroxypropionyl .alpha.-methylfentany (%):Time after the injection(0?24 h)- 0.1-0.03, limit of quantification - (24?48 h), limit of detection- (48?72 h)

Related Record Type Details


					8FU589W85C

.ALPHA.-METHYLFENTANYL

ACTIVE MOIETY

Comments:

ED50-PO(mg/kg) = 0.0058, LD50-PO(mg/kg) = 8.6, Potency ratio to morphine = 56.9, Potency ratio to fentanyl = 1.1