N-(4-methoxyphenyl)-3-phenylimidazole-4-carboxamide

C17H15N3O2 — CID 9267164

IUPACN-(4-methoxyphenyl)-3-phenylimidazole-4-carboxamide
SMILESCOc1ccc(NC(=O)c2cncn2-c2ccccc2)cc1
InChIInChI=1S/C17H15N3O2/c1-22-15-9-7-13(8-10-15)19-17(21)16-11-18-12-20(16)14-5-3-2-4-6-14/h2-12H,1H3,(H,19,21)
InChIKeyORIQDBUQNKTRLE-UHFFFAOYSA-N
MW293.33 g/mol
LogP3.13
Rot. Bonds4

About N-(4-methoxyphenyl)-3-phenylimidazole-4-carboxamide

N-(4-methoxyphenyl)-3-phenylimidazole-4-carboxamide (PubChem CID 9267164) has the molecular formula C17H15N3O2 and a molecular weight of 293.33 g/mol. Its IUPAC name is N-(4-methoxyphenyl)-3-phenylimidazole-4-carboxamide.

Molecular Properties

Compound NameN-(4-methoxyphenyl)-3-phenylimidazole-4-carboxamide
PubChem CID9267164
Molecular FormulaC17H15N3O2
Molecular Weight293.33 g/mol
Exact Mass293.12
IUPAC NameN-(4-methoxyphenyl)-3-phenylimidazole-4-carboxamide
SMILESCOc1ccc(NC(=O)c2cncn2-c2ccccc2)cc1
InChIInChI=1S/C17H15N3O2/c1-22-15-9-7-13(8-10-15)19-17(21)16-11-18-12-20(16)14-5-3-2-4-6-14/h2-12H,1H3,(H,19,21)
InChIKeyORIQDBUQNKTRLE-UHFFFAOYSA-N
XLogP3.13
TPSA56.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.33
LogP ≤ 53.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4-ethoxyphenyl)pyrazine-2-carboxamide
CID 862101
N-[4-[4-(2-methoxyphenyl)piperazin-1-yl]butyl]-N,3-dimethyl-2-methylsulfanylimidazole-4-carboxamide
CID 11305004
N-[4-[4-(2-methoxyphenyl)piperazin-1-yl]butyl]imidazo[1,2-a]pyridine-2-carboxamide
CID 11675867
3-(1H-imidazol-1-yl)-N-(4-methoxyphenyl)butanamide
CID 24761487
N'-(4-butoxyphenyl)-N-(3-imidazol-1-ylpropyl)oxamide
CID 580554
7-[2-hydroxy-3-(4-methoxyanilino)propyl]-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
CID 2818416
2-(2-chlorophenyl)-N-cyclohexyl-1-(4-methoxyphenyl)-1H-imidazole-4-carboxamide
CID 44425204
1-(3,4-Dimethoxyphenyl)-3-[3-(5-methylimidazol-1-yl)propyl]-1-phenylurea
CID 155514984
1-amino-N-(3-methoxyphenyl)pyrazino[1,2-a]benzimidazole-3-carboxamide
CID 168272400
N-(3-imidazol-1-ylpropyl)-N'-(4-methoxyphenyl)oxamide
CID 2856001
N-(3-methoxyphenyl)-1H-imidazole-4-carboxamide
CID 5299203
1H-Imidazole-4-carboxamide, N-(4-methoxyphenyl)-
CID 5297379

Frequently Asked Questions

What is the IUPAC name of N-(4-methoxyphenyl)-3-phenylimidazole-4-carboxamide?
The IUPAC name of N-(4-methoxyphenyl)-3-phenylimidazole-4-carboxamide (CID 9267164) is N-(4-methoxyphenyl)-3-phenylimidazole-4-carboxamide.
What is the SMILES notation for N-(4-methoxyphenyl)-3-phenylimidazole-4-carboxamide?
The canonical SMILES for N-(4-methoxyphenyl)-3-phenylimidazole-4-carboxamide is COc1ccc(NC(=O)c2cncn2-c2ccccc2)cc1.
What is the InChIKey of N-(4-methoxyphenyl)-3-phenylimidazole-4-carboxamide?
The InChIKey is ORIQDBUQNKTRLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15N3O2/c1-22-15-9-7-13(8-10-15)19-17(21)16-11-18-12-20(16)14-5-3-2-4-6-14/h2-12H,1H3,(H,19,21).
What are the key properties of N-(4-methoxyphenyl)-3-phenylimidazole-4-carboxamide?
N-(4-methoxyphenyl)-3-phenylimidazole-4-carboxamide has a molecular weight of 293.33 g/mol, XLogP of 3.13, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methoxyphenyl)-3-phenylimidazole-4-carboxamide is sourced from PubChem (CID 9267164), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).