2-(4-chlorophenyl)-N-[(2-imidazol-1-ylphenyl)methyl]acetamide

C18H16ClN3O — CID 92680055

IUPAC2-(4-chlorophenyl)-N-[(2-imidazol-1-ylphenyl)methyl]acetamide
SMILESO=C(Cc1ccc(Cl)cc1)NCc1ccccc1-n1ccnc1
InChIInChI=1S/C18H16ClN3O/c19-16-7-5-14(6-8-16)11-18(23)21-12-15-3-1-2-4-17(15)22-10-9-20-13-22/h1-10,13H,11-12H2,(H,21,23)
InChIKeyYUQQYNPDLYSWDK-UHFFFAOYSA-N
MW325.80 g/mol
LogP3.38
Rot. Bonds5

About 2-(4-chlorophenyl)-N-[(2-imidazol-1-ylphenyl)methyl]acetamide

2-(4-chlorophenyl)-N-[(2-imidazol-1-ylphenyl)methyl]acetamide (PubChem CID 92680055) has the molecular formula C18H16ClN3O and a molecular weight of 325.80 g/mol. Its IUPAC name is 2-(4-chlorophenyl)-N-[(2-imidazol-1-ylphenyl)methyl]acetamide.

Molecular Properties

Compound Name2-(4-chlorophenyl)-N-[(2-imidazol-1-ylphenyl)methyl]acetamide
PubChem CID92680055
Molecular FormulaC18H16ClN3O
Molecular Weight325.80 g/mol
Exact Mass325.10
IUPAC Name2-(4-chlorophenyl)-N-[(2-imidazol-1-ylphenyl)methyl]acetamide
SMILESO=C(Cc1ccc(Cl)cc1)NCc1ccccc1-n1ccnc1
InChIInChI=1S/C18H16ClN3O/c19-16-7-5-14(6-8-16)11-18(23)21-12-15-3-1-2-4-17(15)22-10-9-20-13-22/h1-10,13H,11-12H2,(H,21,23)
InChIKeyYUQQYNPDLYSWDK-UHFFFAOYSA-N
XLogP3.38
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.80
LogP ≤ 53.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-[(4-chlorophenyl)sulfanylmethyl]-N-[(2-imidazol-1-ylphenyl)methyl]benzamide
CID 43908168
2-[(3,4-dichlorophenyl)methylsulfanyl]-N-[(2-imidazol-1-ylphenyl)methyl]acetamide
CID 92686269
2-[(2-chlorophenyl)methylsulfanyl]-N-[(2-imidazol-1-ylphenyl)methyl]acetamide
CID 30388148
1-[2-(4-chlorophenyl)sulfanylethyl]-3-[(2-imidazol-1-ylphenyl)methyl]urea
CID 60580594
3,4-difluoro-N-[2-[(2-imidazol-1-ylphenyl)methylamino]-2-oxoethyl]benzamide
CID 136578908
2-(2,5-dimethylphenyl)-N-[(2-imidazol-1-ylphenyl)methyl]acetamide
CID 46771389
N-[(2-imidazol-1-ylphenyl)methyl]-3-phenylsulfanylpropanamide
CID 92680048
4-(2,4-dichlorophenoxy)-N-[(2-imidazol-1-ylphenyl)methyl]butanamide
CID 52740396
N-[(2-imidazol-1-ylphenyl)methyl]thiadiazole-4-carboxamide
CID 84595607
N-[(2-imidazol-1-ylphenyl)methyl]-2-pyridin-4-ylsulfanylacetamide
CID 131924662
2-(2,6-dimethoxyphenyl)-N-[(2-imidazol-1-ylphenyl)methyl]acetamide
CID 136514293
2-[N-(benzenesulfonyl)-2,4-dichloroanilino]-N-[(2-imidazol-1-ylphenyl)methyl]acetamide
CID 92673863

Frequently Asked Questions

What is the IUPAC name of 2-(4-chlorophenyl)-N-[(2-imidazol-1-ylphenyl)methyl]acetamide?
The IUPAC name of 2-(4-chlorophenyl)-N-[(2-imidazol-1-ylphenyl)methyl]acetamide (CID 92680055) is 2-(4-chlorophenyl)-N-[(2-imidazol-1-ylphenyl)methyl]acetamide.
What is the SMILES notation for 2-(4-chlorophenyl)-N-[(2-imidazol-1-ylphenyl)methyl]acetamide?
The canonical SMILES for 2-(4-chlorophenyl)-N-[(2-imidazol-1-ylphenyl)methyl]acetamide is O=C(Cc1ccc(Cl)cc1)NCc1ccccc1-n1ccnc1.
What is the InChIKey of 2-(4-chlorophenyl)-N-[(2-imidazol-1-ylphenyl)methyl]acetamide?
The InChIKey is YUQQYNPDLYSWDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16ClN3O/c19-16-7-5-14(6-8-16)11-18(23)21-12-15-3-1-2-4-17(15)22-10-9-20-13-22/h1-10,13H,11-12H2,(H,21,23).
What are the key properties of 2-(4-chlorophenyl)-N-[(2-imidazol-1-ylphenyl)methyl]acetamide?
2-(4-chlorophenyl)-N-[(2-imidazol-1-ylphenyl)methyl]acetamide has a molecular weight of 325.80 g/mol, XLogP of 3.38, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chlorophenyl)-N-[(2-imidazol-1-ylphenyl)methyl]acetamide is sourced from PubChem (CID 92680055), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).