N-[3-(5-methyl-1H-imidazol-4-yl)phenyl]benzamide

C17H15N3O — CID 110735763

IUPACN-[3-(5-methyl-1H-imidazol-4-yl)phenyl]benzamide
SMILESCc1[nH]cnc1-c1cccc(NC(=O)c2ccccc2)c1
InChIInChI=1S/C17H15N3O/c1-12-16(19-11-18-12)14-8-5-9-15(10-14)20-17(21)13-6-3-2-4-7-13/h2-11H,1H3,(H,18,19)(H,20,21)
InChIKeyMHXSSWXLCDKUIP-UHFFFAOYSA-N
MW277.33 g/mol
LogP3.64
Rot. Bonds3

About N-[3-(5-methyl-1H-imidazol-4-yl)phenyl]benzamide

N-[3-(5-methyl-1H-imidazol-4-yl)phenyl]benzamide (PubChem CID 110735763) has the molecular formula C17H15N3O and a molecular weight of 277.33 g/mol. Its IUPAC name is N-[3-(5-methyl-1H-imidazol-4-yl)phenyl]benzamide.

Molecular Properties

Compound NameN-[3-(5-methyl-1H-imidazol-4-yl)phenyl]benzamide
PubChem CID110735763
Molecular FormulaC17H15N3O
Molecular Weight277.33 g/mol
Exact Mass277.12
IUPAC NameN-[3-(5-methyl-1H-imidazol-4-yl)phenyl]benzamide
SMILESCc1[nH]cnc1-c1cccc(NC(=O)c2ccccc2)c1
InChIInChI=1S/C17H15N3O/c1-12-16(19-11-18-12)14-8-5-9-15(10-14)20-17(21)13-6-3-2-4-7-13/h2-11H,1H3,(H,18,19)(H,20,21)
InChIKeyMHXSSWXLCDKUIP-UHFFFAOYSA-N
XLogP3.64
TPSA57.78 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.33
LogP ≤ 53.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[4-(5-methyl-1H-imidazol-4-yl)phenyl]benzamide
CID 110735677
N-[3-(5-methyl-1H-imidazol-4-yl)phenyl]-4-pyrrol-1-ylbenzamide
CID 110745870
N-[3-(5-methyl-1H-imidazol-4-yl)phenyl]-2-oxochromene-3-carboxamide
CID 110745871
methyl 4-[3-(5-methyl-1H-imidazol-4-yl)anilino]-4-oxobutanoate
CID 110735757
2-(4-ethoxyphenyl)-N-[3-(5-methyl-1H-imidazol-4-yl)phenyl]acetamide
CID 110745856
N-[3-(2-methyl-1,3-thiazol-4-yl)phenyl]benzamide
CID 766934
N-(3-benzamidophenyl)-6-methyl-4-oxo-3H-furo[2,3-d]pyrimidine-5-carboxamide
CID 55869447
3-methyl-N-(3-quinoxalin-2-ylphenyl)benzamide
CID 2224328
N-(3-methylphenyl)-2-phenylpyrimidine-5-carboxamide
CID 3634035
4-(2-hydroxypropan-2-yl)-N-(3-pyridin-2-ylphenyl)benzamide
CID 142392143
N-[3-(3-methylimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]benzamide
CID 43936475
N-(4-oxo-3H-quinazolin-6-yl)benzamide
CID 174817735

Frequently Asked Questions

What is the IUPAC name of N-[3-(5-methyl-1H-imidazol-4-yl)phenyl]benzamide?
The IUPAC name of N-[3-(5-methyl-1H-imidazol-4-yl)phenyl]benzamide (CID 110735763) is N-[3-(5-methyl-1H-imidazol-4-yl)phenyl]benzamide.
What is the SMILES notation for N-[3-(5-methyl-1H-imidazol-4-yl)phenyl]benzamide?
The canonical SMILES for N-[3-(5-methyl-1H-imidazol-4-yl)phenyl]benzamide is Cc1[nH]cnc1-c1cccc(NC(=O)c2ccccc2)c1.
What is the InChIKey of N-[3-(5-methyl-1H-imidazol-4-yl)phenyl]benzamide?
The InChIKey is MHXSSWXLCDKUIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15N3O/c1-12-16(19-11-18-12)14-8-5-9-15(10-14)20-17(21)13-6-3-2-4-7-13/h2-11H,1H3,(H,18,19)(H,20,21).
What are the key properties of N-[3-(5-methyl-1H-imidazol-4-yl)phenyl]benzamide?
N-[3-(5-methyl-1H-imidazol-4-yl)phenyl]benzamide has a molecular weight of 277.33 g/mol, XLogP of 3.64, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(5-methyl-1H-imidazol-4-yl)phenyl]benzamide is sourced from PubChem (CID 110735763), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).