(R)-2-[6-(3-Aminopiperidin-1-yl)-3-methyl-2,4-dioxo-3,4-dihydro-2H-pyrimidin-1-ylmethyl]-4-fluorobenzamide

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C18H22FN5O3
Molecular Weight	375.3974
Optical Activity	UNSPECIFIED
Defined Stereocenters	1 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of (R)-2-[6-(3-Aminopiperidin-1-yl)-3-methyl-2,4-dioxo-3,4-dihydro-2H-pyrimidin-1-ylmethyl]-4-fluorobenzamide

Structure Search

SMILES

CN1C(=O)C=C(N2CCC[C@@H](N)C2)N(CC3=CC(F)=CC=C3C(N)=O)C1=O

InChI

InChIKey=AKNPUJHLPMLIQG-CYBMUJFWSA-N

InChI=1S/C18H22FN5O3/c1-22-16(25)8-15(23-6-2-3-13(20)10-23)24(18(22)27)9-11-7-12(19)4-5-14(11)17(21)26/h4-5,7-8,13H,2-3,6,9-10,20H2,1H3,(H2,21,26)/t13-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C18H22FN5O3
Molecular Weight	375.3974
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	1 / 1
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Wed Apr 02 17:29:42 GMT 2025` Edited by `admin` on `Wed Apr 02 17:29:42 GMT 2025`
Record UNII	MN553E7FBX
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

Trelagliptin Impurity 3

Preferred Name

English

(R)-2-[6-(3-Aminopiperidin-1-yl)-3-methyl-2,4-dioxo-3,4-dihydro-2H-pyrimidin-1-ylmethyl]-4-fluorobenzamide

Systematic Name

English

2-[[6-[(3R)-3-Amino-1-piperidinyl]-3,4-dihydro-3-methyl-2,4-dioxo-1(2H)-pyrimidinyl]methyl]-4-fluorobenzamide

Systematic Name

English

Benzamide, 2-[[6-[(3R)-3-amino-1-piperidinyl]-3,4-dihydro-3-methyl-2,4-dioxo-1(2H)-pyrimidinyl]methyl]-4-fluoro-

Systematic Name

English

Code System Code Type Description

FDA UNII

MN553E7FBX

Created by admin on Wed Apr 02 17:29:42 GMT 2025 , Edited by admin on Wed Apr 02 17:29:42 GMT 2025

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CAS

1938080-44-4

Created by admin on Wed Apr 02 17:29:42 GMT 2025 , Edited by admin on Wed Apr 02 17:29:42 GMT 2025

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PUBCHEM

145710637

Created by admin on Wed Apr 02 17:29:42 GMT 2025 , Edited by admin on Wed Apr 02 17:29:42 GMT 2025

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