N-methyl-6-oxo-1-phenylpyrimidine-5-carboxamide

C12H11N3O2 — CID 143596490

IUPACN-methyl-6-oxo-1-phenylpyrimidine-5-carboxamide
SMILESCNC(=O)c1cncn(-c2ccccc2)c1=O
InChIInChI=1S/C12H11N3O2/c1-13-11(16)10-7-14-8-15(12(10)17)9-5-3-2-4-6-9/h2-8H,1H3,(H,13,16)
InChIKeyLCVLMZGEYARGTQ-UHFFFAOYSA-N
MW229.24 g/mol
LogP0.59
Rot. Bonds2

About N-methyl-6-oxo-1-phenylpyrimidine-5-carboxamide

N-methyl-6-oxo-1-phenylpyrimidine-5-carboxamide (PubChem CID 143596490) has the molecular formula C12H11N3O2 and a molecular weight of 229.24 g/mol. Its IUPAC name is N-methyl-6-oxo-1-phenylpyrimidine-5-carboxamide.

Molecular Properties

Compound NameN-methyl-6-oxo-1-phenylpyrimidine-5-carboxamide
PubChem CID143596490
Molecular FormulaC12H11N3O2
Molecular Weight229.24 g/mol
Exact Mass229.09
IUPAC NameN-methyl-6-oxo-1-phenylpyrimidine-5-carboxamide
SMILESCNC(=O)c1cncn(-c2ccccc2)c1=O
InChIInChI=1S/C12H11N3O2/c1-13-11(16)10-7-14-8-15(12(10)17)9-5-3-2-4-6-9/h2-8H,1H3,(H,13,16)
InChIKeyLCVLMZGEYARGTQ-UHFFFAOYSA-N
XLogP0.59
TPSA63.99 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.24
LogP ≤ 50.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(4-fluorophenyl)-N-methyl-6-oxopyrimidine-5-carboxamide
CID 143536437
N-methyl-2-oxo-1-phenylpyridine-3-carboxamide
CID 143596637
N,1-dimethyl-6-oxopyrimidine-5-carboxamide
CID 141080909
1-(4-fluorophenyl)-6-oxopyrimidine-5-carboxylic acid
CID 137153602
N-ethyl-3-phenylimidazole-4-carboxamide
CID 47109591
ethane;N-methyl-6-oxo-1-phenylpyridine-3-carboxamide
CID 142575628
methyl (2S)-2-[(3-phenylimidazole-4-carbonyl)amino]propanoate
CID 87040197
1-(4-acetamidophenyl)-N-methyl-2-oxopyridine-3-carboxamide
CID 20974500
4-(methylcarbamoyl)pyridine-3-carboxylic acid
CID 130493888
N,1,6-trimethyl-2-oxopyridine-3-carboxamide
CID 131179511
N-methyl-1-phenyl-1,2,4-triazole-3-carboxamide
CID 139472699
N-(3-amino-2-methylpropyl)-3-phenylimidazole-4-carboxamide
CID 119996977

Frequently Asked Questions

What is the IUPAC name of N-methyl-6-oxo-1-phenylpyrimidine-5-carboxamide?
The IUPAC name of N-methyl-6-oxo-1-phenylpyrimidine-5-carboxamide (CID 143596490) is N-methyl-6-oxo-1-phenylpyrimidine-5-carboxamide.
What is the SMILES notation for N-methyl-6-oxo-1-phenylpyrimidine-5-carboxamide?
The canonical SMILES for N-methyl-6-oxo-1-phenylpyrimidine-5-carboxamide is CNC(=O)c1cncn(-c2ccccc2)c1=O.
What is the InChIKey of N-methyl-6-oxo-1-phenylpyrimidine-5-carboxamide?
The InChIKey is LCVLMZGEYARGTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11N3O2/c1-13-11(16)10-7-14-8-15(12(10)17)9-5-3-2-4-6-9/h2-8H,1H3,(H,13,16).
What are the key properties of N-methyl-6-oxo-1-phenylpyrimidine-5-carboxamide?
N-methyl-6-oxo-1-phenylpyrimidine-5-carboxamide has a molecular weight of 229.24 g/mol, XLogP of 0.59, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-6-oxo-1-phenylpyrimidine-5-carboxamide is sourced from PubChem (CID 143596490), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).