8-METHYLAMINOCAFFEINE

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C9H13N5O2
Molecular Weight	223.2318
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 8-METHYLAMINOCAFFEINE

Structure Search

SMILES

CNC1=NC2=C(N1C)C(=O)N(C)C(=O)N2C

InChI

InChIKey=FCCZIRITMFVXOZ-UHFFFAOYSA-N

InChI=1S/C9H13N5O2/c1-10-8-11-6-5(12(8)2)7(15)14(4)9(16)13(6)3/h1-4H3,(H,10,11)

HIDE SMILES / InChI

Molecular Formula	C9H13N5O2
Molecular Weight	223.2318
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Approval Year

Substance Class	Chemical Created by `admin` on `Mon Mar 31 19:00:01 GMT 2025` Edited by `admin` on `Mon Mar 31 19:00:01 GMT 2025`
Record UNII	8980LXK786
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

8-METHYLAMINOCAFFEINE

Systematic Name

English

NSC-8810

Preferred Name

English

METHYLAMINOCAFFEINE, 8-

Systematic Name

English

Code System Code Type Description

PUBCHEM

64118

Created by admin on Mon Mar 31 19:00:01 GMT 2025 , Edited by admin on Mon Mar 31 19:00:01 GMT 2025

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FDA UNII

8980LXK786

Created by admin on Mon Mar 31 19:00:01 GMT 2025 , Edited by admin on Mon Mar 31 19:00:01 GMT 2025

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EPA CompTox

DTXSID90202571

Created by admin on Mon Mar 31 19:00:01 GMT 2025 , Edited by admin on Mon Mar 31 19:00:01 GMT 2025

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NSC

8810

Created by admin on Mon Mar 31 19:00:01 GMT 2025 , Edited by admin on Mon Mar 31 19:00:01 GMT 2025

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CAS

5422-30-0

Created by admin on Mon Mar 31 19:00:01 GMT 2025 , Edited by admin on Mon Mar 31 19:00:01 GMT 2025

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