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

C17H15N3O — CID 110735677

IUPACN-[4-(5-methyl-1H-imidazol-4-yl)phenyl]benzamide
SMILESCc1[nH]cnc1-c1ccc(NC(=O)c2ccccc2)cc1
InChIInChI=1S/C17H15N3O/c1-12-16(19-11-18-12)13-7-9-15(10-8-13)20-17(21)14-5-3-2-4-6-14/h2-11H,1H3,(H,18,19)(H,20,21)
InChIKeyRLRACJPYULJJRC-UHFFFAOYSA-N
MW277.33 g/mol
LogP3.64
Rot. Bonds3

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

N-[4-(5-methyl-1H-imidazol-4-yl)phenyl]benzamide (PubChem CID 110735677) has the molecular formula C17H15N3O and a molecular weight of 277.33 g/mol. Its IUPAC name is N-[4-(5-methyl-1H-imidazol-4-yl)phenyl]benzamide.

Molecular Properties

Compound NameN-[4-(5-methyl-1H-imidazol-4-yl)phenyl]benzamide
PubChem CID110735677
Molecular FormulaC17H15N3O
Molecular Weight277.33 g/mol
Exact Mass277.12
IUPAC NameN-[4-(5-methyl-1H-imidazol-4-yl)phenyl]benzamide
SMILESCc1[nH]cnc1-c1ccc(NC(=O)c2ccccc2)cc1
InChIInChI=1S/C17H15N3O/c1-12-16(19-11-18-12)13-7-9-15(10-8-13)20-17(21)14-5-3-2-4-6-14/h2-11H,1H3,(H,18,19)(H,20,21)
InChIKeyRLRACJPYULJJRC-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-[3-(5-methyl-1H-imidazol-4-yl)phenyl]benzamide
CID 110735763
2-methoxy-N-[4-(5-methyl-1H-imidazol-4-yl)phenyl]benzamide
CID 110735682
N-[4-(5-methyl-1H-imidazol-4-yl)phenyl]-2-phenoxyacetamide
CID 110735692
N-[4-(4-phenylphenyl)phenyl]benzamide
CID 59742294
(4-benzamidophenyl)carbamic acid
CID 18543096
N-[3-(5-methyl-1H-imidazol-4-yl)phenyl]-4-pyrrol-1-ylbenzamide
CID 110745870
N-[4-(5-methyl-1H-imidazol-4-yl)phenyl]oxolane-2-carboxamide
CID 110735670
molecular hydrogen;N-phenylbenzamide
CID 145238042
N-[4-(5-benzamido-2-pyridinyl)phenyl]benzamide
CID 86766305
N-(5-methyl-3-phenyl-1H-pyrazol-4-yl)benzamide
CID 14183157
N-(4-tert-butylphenyl)-5-methyl-1H-imidazole-4-carboxamide
CID 110683972
N-[4-(5-methyl-4-phenyltriazol-1-yl)phenyl]benzamide
CID 13162137

Frequently Asked Questions

What is the IUPAC name of N-[4-(5-methyl-1H-imidazol-4-yl)phenyl]benzamide?
The IUPAC name of N-[4-(5-methyl-1H-imidazol-4-yl)phenyl]benzamide (CID 110735677) is N-[4-(5-methyl-1H-imidazol-4-yl)phenyl]benzamide.
What is the SMILES notation for N-[4-(5-methyl-1H-imidazol-4-yl)phenyl]benzamide?
The canonical SMILES for N-[4-(5-methyl-1H-imidazol-4-yl)phenyl]benzamide is Cc1[nH]cnc1-c1ccc(NC(=O)c2ccccc2)cc1.
What is the InChIKey of N-[4-(5-methyl-1H-imidazol-4-yl)phenyl]benzamide?
The InChIKey is RLRACJPYULJJRC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15N3O/c1-12-16(19-11-18-12)13-7-9-15(10-8-13)20-17(21)14-5-3-2-4-6-14/h2-11H,1H3,(H,18,19)(H,20,21).
What are the key properties of N-[4-(5-methyl-1H-imidazol-4-yl)phenyl]benzamide?
N-[4-(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-[4-(5-methyl-1H-imidazol-4-yl)phenyl]benzamide is sourced from PubChem (CID 110735677), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).