Chemical Components in the PDB

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NFM : Summary

Code

NFM

One-letter code

X

Molecule name

N-[(4-amino-2-methylpyrimidin-5-yl)methyl]formamide

Systematic names

ProgramVersionName
ACDLabs 11.02 N-[(4-amino-2-methylpyrimidin-5-yl)methyl]formamide
OpenEye OEToolkits 1.6.1 N-[(4-azanyl-2-methyl-pyrimidin-5-yl)methyl]methanamide

Formula

C7 H10 N4 O

Formal charge

0

Molecular weight

166.18 Da

SMILES

TypeProgramVersionDescriptor
SMILES ACDLabs 11.02 O=CNCc1cnc(nc1N)C
SMILES CACTVS 3.352 Cc1ncc(CNC=O)c(N)n1
SMILES OpenEye OEToolkits 1.7.0 Cc1ncc(c(n1)N)CNC=O
Canonical SMILES CACTVS 3.352 Cc1ncc(CNC=O)c(N)n1
Canonical SMILES OpenEye OEToolkits 1.7.0 Cc1ncc(c(n1)N)CNC=O

IUPAC InChI

InChI=1S/C7H10N4O/c1-5-10-3-6(2-9-4-12)7(8)11-5/h3-4H,2H2,1H3,(H,9,12)(H2,8,10,11)

IUPAC InChI key

PVWNFAGYFUUDRC-UHFFFAOYSA-N
NFM

wwPDB Information

Atom count

22 (12 without Hydrogen)

Polymer type

Bound ligand

Type description

NON-POLYMER

Type code

HETAIN

Is modified

No

Standard parent

Not Assigned

Defined at

2009-09-04

Last modified at

2011-06-04

Status

Released

Obsoleted

Not Assigned