N-(4-imidazol-1-ylphenyl)-2-(4-methylphenyl)acetamide

C18H17N3O — CID 37194021

IUPACN-(4-imidazol-1-ylphenyl)-2-(4-methylphenyl)acetamide
SMILESCc1ccc(CC(=O)Nc2ccc(-n3ccnc3)cc2)cc1
InChIInChI=1S/C18H17N3O/c1-14-2-4-15(5-3-14)12-18(22)20-16-6-8-17(9-7-16)21-11-10-19-13-21/h2-11,13H,12H2,1H3,(H,20,22)
InChIKeyURDAVFIIBRPVNH-UHFFFAOYSA-N
MW291.35 g/mol
LogP3.36
Rot. Bonds4

About N-(4-imidazol-1-ylphenyl)-2-(4-methylphenyl)acetamide

N-(4-imidazol-1-ylphenyl)-2-(4-methylphenyl)acetamide (PubChem CID 37194021) has the molecular formula C18H17N3O and a molecular weight of 291.35 g/mol. Its IUPAC name is N-(4-imidazol-1-ylphenyl)-2-(4-methylphenyl)acetamide.

Molecular Properties

Compound NameN-(4-imidazol-1-ylphenyl)-2-(4-methylphenyl)acetamide
PubChem CID37194021
Molecular FormulaC18H17N3O
Molecular Weight291.35 g/mol
Exact Mass291.14
IUPAC NameN-(4-imidazol-1-ylphenyl)-2-(4-methylphenyl)acetamide
SMILESCc1ccc(CC(=O)Nc2ccc(-n3ccnc3)cc2)cc1
InChIInChI=1S/C18H17N3O/c1-14-2-4-15(5-3-14)12-18(22)20-16-6-8-17(9-7-16)21-11-10-19-13-21/h2-11,13H,12H2,1H3,(H,20,22)
InChIKeyURDAVFIIBRPVNH-UHFFFAOYSA-N
XLogP3.36
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.35
LogP ≤ 53.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-hydroxyphenyl)-N-(4-imidazol-1-ylphenyl)acetamide
CID 78845003
N-(4-imidazol-1-ylphenyl)acetamide
CID 16761727
N-(4-imidazol-1-ylphenyl)-2-(2-methoxyphenyl)acetamide
CID 31409632
N-(4-imidazol-1-ylphenyl)-3-(5-methyl-1,3-dioxoisoindol-2-yl)propanamide
CID 37186591
2-[2-(4-imidazol-1-ylanilino)-2-oxoethyl]benzoic acid
CID 56762074
ethyl N-[2-(4-imidazol-1-ylanilino)-2-oxoethyl]carbamate
CID 47078318
N-[(4-imidazol-1-ylphenyl)methyl]-2-[(4-methylphenyl)methylsulfanyl]acetamide
CID 92678471
N-[(4-imidazol-1-ylphenyl)methyl]-2-(4-methylphenyl)sulfanylacetamide
CID 46772928
2-(4-imidazol-1-ylphenyl)acetic acid;hydrochloride
CID 122163959
1-[(1R)-1-(4-imidazol-1-ylphenyl)ethyl]-3-(4-methylphenyl)urea
CID 25339932
2-(2,5-dimethoxyphenyl)-N-(4-imidazol-1-ylphenyl)acetamide
CID 78845002
ethyl 2-(4-imidazol-1-ylanilino)-2-oxoacetate
CID 19438777

Frequently Asked Questions

What is the IUPAC name of N-(4-imidazol-1-ylphenyl)-2-(4-methylphenyl)acetamide?
The IUPAC name of N-(4-imidazol-1-ylphenyl)-2-(4-methylphenyl)acetamide (CID 37194021) is N-(4-imidazol-1-ylphenyl)-2-(4-methylphenyl)acetamide.
What is the SMILES notation for N-(4-imidazol-1-ylphenyl)-2-(4-methylphenyl)acetamide?
The canonical SMILES for N-(4-imidazol-1-ylphenyl)-2-(4-methylphenyl)acetamide is Cc1ccc(CC(=O)Nc2ccc(-n3ccnc3)cc2)cc1.
What is the InChIKey of N-(4-imidazol-1-ylphenyl)-2-(4-methylphenyl)acetamide?
The InChIKey is URDAVFIIBRPVNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17N3O/c1-14-2-4-15(5-3-14)12-18(22)20-16-6-8-17(9-7-16)21-11-10-19-13-21/h2-11,13H,12H2,1H3,(H,20,22).
What are the key properties of N-(4-imidazol-1-ylphenyl)-2-(4-methylphenyl)acetamide?
N-(4-imidazol-1-ylphenyl)-2-(4-methylphenyl)acetamide has a molecular weight of 291.35 g/mol, XLogP of 3.36, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-imidazol-1-ylphenyl)-2-(4-methylphenyl)acetamide is sourced from PubChem (CID 37194021), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).