4-(imidazol-1-ylmethyl)-N-(2-phenylethenyl)benzamide

C19H17N3O — CID 174355891

IUPAC4-(imidazol-1-ylmethyl)-N-(2-phenylethenyl)benzamide
SMILESO=C(NC=Cc1ccccc1)c1ccc(Cn2ccnc2)cc1
InChIInChI=1S/C19H17N3O/c23-19(21-11-10-16-4-2-1-3-5-16)18-8-6-17(7-9-18)14-22-13-12-20-15-22/h1-13,15H,14H2,(H,21,23)
InChIKeyZNQCPCBTYNDAEV-UHFFFAOYSA-N
MW303.37 g/mol
LogP3.33
Rot. Bonds5

About 4-(imidazol-1-ylmethyl)-N-(2-phenylethenyl)benzamide

4-(imidazol-1-ylmethyl)-N-(2-phenylethenyl)benzamide (PubChem CID 174355891) has the molecular formula C19H17N3O and a molecular weight of 303.37 g/mol. Its IUPAC name is 4-(imidazol-1-ylmethyl)-N-(2-phenylethenyl)benzamide.

Molecular Properties

Compound Name4-(imidazol-1-ylmethyl)-N-(2-phenylethenyl)benzamide
PubChem CID174355891
Molecular FormulaC19H17N3O
Molecular Weight303.37 g/mol
Exact Mass303.14
IUPAC Name4-(imidazol-1-ylmethyl)-N-(2-phenylethenyl)benzamide
SMILESO=C(NC=Cc1ccccc1)c1ccc(Cn2ccnc2)cc1
InChIInChI=1S/C19H17N3O/c23-19(21-11-10-16-4-2-1-3-5-16)18-8-6-17(7-9-18)14-22-13-12-20-15-22/h1-13,15H,14H2,(H,21,23)
InChIKeyZNQCPCBTYNDAEV-UHFFFAOYSA-N
XLogP3.33
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.37
LogP ≤ 53.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(benzylideneamino)-4-(imidazol-1-ylmethyl)benzamide
CID 86084165
(Z)-N-[4-(imidazol-1-ylmethyl)phenyl]-3-phenylprop-2-enamide
CID 69488579
4-(imidazol-1-ylmethyl)-N-(1-phenylethyl)benzamide
CID 42959098
benzaldehyde;1-benzylimidazole
CID 23446402
N-(2-fluorophenyl)-4-(imidazol-1-ylmethyl)benzamide
CID 43921399
N-[(1R)-1,2-diphenylethyl]-4-(imidazol-1-ylmethyl)benzamide
CID 95297781
sodium;hydride;(E)-3-[4-(imidazol-1-ylmethyl)phenyl]prop-2-enoic acid
CID 173012997
N-tert-butyl-4-(imidazol-1-ylmethyl)benzamide
CID 43918479
4-(imidazol-1-ylmethyl)-N-propan-2-ylbenzamide
CID 43918416
N-cyclopentyl-4-(imidazol-1-ylmethyl)benzamide
CID 43918576
4-(imidazol-1-ylmethyl)-N-(pyridin-2-ylmethyl)benzamide
CID 43921854
N-[2-(dimethylamino)ethyl]-4-(imidazol-1-ylmethyl)benzamide
CID 46774109

Frequently Asked Questions

What is the IUPAC name of 4-(imidazol-1-ylmethyl)-N-(2-phenylethenyl)benzamide?
The IUPAC name of 4-(imidazol-1-ylmethyl)-N-(2-phenylethenyl)benzamide (CID 174355891) is 4-(imidazol-1-ylmethyl)-N-(2-phenylethenyl)benzamide.
What is the SMILES notation for 4-(imidazol-1-ylmethyl)-N-(2-phenylethenyl)benzamide?
The canonical SMILES for 4-(imidazol-1-ylmethyl)-N-(2-phenylethenyl)benzamide is O=C(NC=Cc1ccccc1)c1ccc(Cn2ccnc2)cc1.
What is the InChIKey of 4-(imidazol-1-ylmethyl)-N-(2-phenylethenyl)benzamide?
The InChIKey is ZNQCPCBTYNDAEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17N3O/c23-19(21-11-10-16-4-2-1-3-5-16)18-8-6-17(7-9-18)14-22-13-12-20-15-22/h1-13,15H,14H2,(H,21,23).
What are the key properties of 4-(imidazol-1-ylmethyl)-N-(2-phenylethenyl)benzamide?
4-(imidazol-1-ylmethyl)-N-(2-phenylethenyl)benzamide has a molecular weight of 303.37 g/mol, XLogP of 3.33, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(imidazol-1-ylmethyl)-N-(2-phenylethenyl)benzamide is sourced from PubChem (CID 174355891), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).