4-amino-3-(4-methylphenyl)-1H-imidazo[4,5-c]pyridin-2-one

C13H12N4O — CID 153011341

IUPAC4-amino-3-(4-methylphenyl)-1H-imidazo[4,5-c]pyridin-2-one
SMILESCc1ccc(-n2c(=O)[nH]c3ccnc(N)c32)cc1
InChIInChI=1S/C13H12N4O/c1-8-2-4-9(5-3-8)17-11-10(16-13(17)18)6-7-15-12(11)14/h2-7H,1H3,(H2,14,15)(H,16,18)
InChIKeyVACPNPZUOJGCKE-UHFFFAOYSA-N
MW240.27 g/mol
LogP1.60
Rot. Bonds1

About 4-amino-3-(4-methylphenyl)-1H-imidazo[4,5-c]pyridin-2-one

4-amino-3-(4-methylphenyl)-1H-imidazo[4,5-c]pyridin-2-one (PubChem CID 153011341) has the molecular formula C13H12N4O and a molecular weight of 240.27 g/mol. Its IUPAC name is 4-amino-3-(4-methylphenyl)-1H-imidazo[4,5-c]pyridin-2-one.

Molecular Properties

Compound Name4-amino-3-(4-methylphenyl)-1H-imidazo[4,5-c]pyridin-2-one
PubChem CID153011341
Molecular FormulaC13H12N4O
Molecular Weight240.27 g/mol
Exact Mass240.10
IUPAC Name4-amino-3-(4-methylphenyl)-1H-imidazo[4,5-c]pyridin-2-one
SMILESCc1ccc(-n2c(=O)[nH]c3ccnc(N)c32)cc1
InChIInChI=1S/C13H12N4O/c1-8-2-4-9(5-3-8)17-11-10(16-13(17)18)6-7-15-12(11)14/h2-7H,1H3,(H2,14,15)(H,16,18)
InChIKeyVACPNPZUOJGCKE-UHFFFAOYSA-N
XLogP1.60
TPSA76.70 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.27
LogP ≤ 51.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-(4-methylphenyl)-1H-pyrido[2,3-d]pyrimidine-2,4-dione
CID 848491
ethane;3-(4-methylphenyl)-1H-quinazoline-2,4-dione
CID 91492397
6-fluoro-3-(4-methylphenyl)-1H-benzimidazol-2-one
CID 110491205
6-amino-3-(2-methyl-4-pyridinyl)-1H-benzimidazol-2-one
CID 110491432
5-(4-methylanilino)-3-(4-methylphenyl)-1H-imidazo[4,5-b]pyridin-2-one
CID 11404740
6-bromo-3-(4-methylphenyl)-1H-quinazoline-2,4-dione
CID 718439
1,3,5-tris(4-methylphenyl)-1,3,5-triazinane-2,4,6-trione
CID 584033
4-methyl-3-[4-(trifluoromethyl)phenyl]-1H-benzimidazol-2-one
CID 117209238
3-(3,5-dimethylphenyl)-4,5-difluoro-1H-benzimidazol-2-one
CID 110491336
5-amino-3-pyridin-4-yl-1H-benzimidazol-2-one
CID 110491548
4,6-diamino-1-(4-methylphenyl)-1,3,5-triazin-2-one
CID 13111420
3-(3,4-dimethylphenyl)-4,5-difluoro-1H-benzimidazol-2-one
CID 110491335

Frequently Asked Questions

What is the IUPAC name of 4-amino-3-(4-methylphenyl)-1H-imidazo[4,5-c]pyridin-2-one?
The IUPAC name of 4-amino-3-(4-methylphenyl)-1H-imidazo[4,5-c]pyridin-2-one (CID 153011341) is 4-amino-3-(4-methylphenyl)-1H-imidazo[4,5-c]pyridin-2-one.
What is the SMILES notation for 4-amino-3-(4-methylphenyl)-1H-imidazo[4,5-c]pyridin-2-one?
The canonical SMILES for 4-amino-3-(4-methylphenyl)-1H-imidazo[4,5-c]pyridin-2-one is Cc1ccc(-n2c(=O)[nH]c3ccnc(N)c32)cc1.
What is the InChIKey of 4-amino-3-(4-methylphenyl)-1H-imidazo[4,5-c]pyridin-2-one?
The InChIKey is VACPNPZUOJGCKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12N4O/c1-8-2-4-9(5-3-8)17-11-10(16-13(17)18)6-7-15-12(11)14/h2-7H,1H3,(H2,14,15)(H,16,18).
What are the key properties of 4-amino-3-(4-methylphenyl)-1H-imidazo[4,5-c]pyridin-2-one?
4-amino-3-(4-methylphenyl)-1H-imidazo[4,5-c]pyridin-2-one has a molecular weight of 240.27 g/mol, XLogP of 1.60, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-3-(4-methylphenyl)-1H-imidazo[4,5-c]pyridin-2-one is sourced from PubChem (CID 153011341), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).