4-(3-phenylphenyl)-1H-imidazole-5-carboxamide

C16H13N3O — CID 16658116

IUPAC4-(3-phenylphenyl)-1H-imidazole-5-carboxamide
SMILESNC(=O)c1[nH]cnc1-c1cccc(-c2ccccc2)c1
InChIInChI=1S/C16H13N3O/c17-16(20)15-14(18-10-19-15)13-8-4-7-12(9-13)11-5-2-1-3-6-11/h1-10H,(H2,17,20)(H,18,19)
InChIKeyXCHBCGDXDAWBKI-UHFFFAOYSA-N
MW263.30 g/mol
LogP2.84
Rot. Bonds3

About 4-(3-phenylphenyl)-1H-imidazole-5-carboxamide

4-(3-phenylphenyl)-1H-imidazole-5-carboxamide (PubChem CID 16658116) has the molecular formula C16H13N3O and a molecular weight of 263.30 g/mol. Its IUPAC name is 4-(3-phenylphenyl)-1H-imidazole-5-carboxamide.

Molecular Properties

Compound Name4-(3-phenylphenyl)-1H-imidazole-5-carboxamide
PubChem CID16658116
Molecular FormulaC16H13N3O
Molecular Weight263.30 g/mol
Exact Mass263.11
IUPAC Name4-(3-phenylphenyl)-1H-imidazole-5-carboxamide
SMILESNC(=O)c1[nH]cnc1-c1cccc(-c2ccccc2)c1
InChIInChI=1S/C16H13N3O/c17-16(20)15-14(18-10-19-15)13-8-4-7-12(9-13)11-5-2-1-3-6-11/h1-10H,(H2,17,20)(H,18,19)
InChIKeyXCHBCGDXDAWBKI-UHFFFAOYSA-N
XLogP2.84
TPSA71.77 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.30
LogP ≤ 52.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-(3-phenylphenyl)-1H-imidazole-5-carboxamide?
The IUPAC name of 4-(3-phenylphenyl)-1H-imidazole-5-carboxamide (CID 16658116) is 4-(3-phenylphenyl)-1H-imidazole-5-carboxamide.
What is the SMILES notation for 4-(3-phenylphenyl)-1H-imidazole-5-carboxamide?
The canonical SMILES for 4-(3-phenylphenyl)-1H-imidazole-5-carboxamide is NC(=O)c1[nH]cnc1-c1cccc(-c2ccccc2)c1.
What is the InChIKey of 4-(3-phenylphenyl)-1H-imidazole-5-carboxamide?
The InChIKey is XCHBCGDXDAWBKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13N3O/c17-16(20)15-14(18-10-19-15)13-8-4-7-12(9-13)11-5-2-1-3-6-11/h1-10H,(H2,17,20)(H,18,19).
What are the key properties of 4-(3-phenylphenyl)-1H-imidazole-5-carboxamide?
4-(3-phenylphenyl)-1H-imidazole-5-carboxamide has a molecular weight of 263.30 g/mol, XLogP of 2.84, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-phenylphenyl)-1H-imidazole-5-carboxamide is sourced from PubChem (CID 16658116), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).