N-(3-acetylphenyl)-4-(imidazol-1-ylmethyl)benzamide

C19H17N3O2 — CID 43924465

IUPACN-(3-acetylphenyl)-4-(imidazol-1-ylmethyl)benzamide
SMILESCC(=O)c1cccc(NC(=O)c2ccc(Cn3ccnc3)cc2)c1
InChIInChI=1S/C19H17N3O2/c1-14(23)17-3-2-4-18(11-17)21-19(24)16-7-5-15(6-8-16)12-22-10-9-20-13-22/h2-11,13H,12H2,1H3,(H,21,24)
InChIKeyAVSAJIXJIQPNQC-UHFFFAOYSA-N
MW319.36 g/mol
LogP3.39
Rot. Bonds5

About N-(3-acetylphenyl)-4-(imidazol-1-ylmethyl)benzamide

N-(3-acetylphenyl)-4-(imidazol-1-ylmethyl)benzamide (PubChem CID 43924465) has the molecular formula C19H17N3O2 and a molecular weight of 319.36 g/mol. Its IUPAC name is N-(3-acetylphenyl)-4-(imidazol-1-ylmethyl)benzamide.

Molecular Properties

Compound NameN-(3-acetylphenyl)-4-(imidazol-1-ylmethyl)benzamide
PubChem CID43924465
Molecular FormulaC19H17N3O2
Molecular Weight319.36 g/mol
Exact Mass319.13
IUPAC NameN-(3-acetylphenyl)-4-(imidazol-1-ylmethyl)benzamide
SMILESCC(=O)c1cccc(NC(=O)c2ccc(Cn3ccnc3)cc2)c1
InChIInChI=1S/C19H17N3O2/c1-14(23)17-3-2-4-18(11-17)21-19(24)16-7-5-15(6-8-16)12-22-10-9-20-13-22/h2-11,13H,12H2,1H3,(H,21,24)
InChIKeyAVSAJIXJIQPNQC-UHFFFAOYSA-N
XLogP3.39
TPSA63.99 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.36
LogP ≤ 53.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-(3-acetylphenyl)-4-(imidazol-1-ylmethyl)benzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[3-(butanoylamino)phenyl]-4-(imidazol-1-ylmethyl)benzamide
CID 87041023
4-(imidazol-1-ylmethyl)-N-[3-(2,2,2-trifluoroethyl)phenyl]benzamide
CID 166201634
4-(imidazol-1-ylmethyl)-N-[3-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]benzamide
CID 86846693
N-(3-chloro-4-methoxyphenyl)-4-(imidazol-1-ylmethyl)benzamide
CID 43922042
N-dibenzofuran-3-yl-4-(imidazol-1-ylmethyl)benzamide
CID 94867844
4-(imidazol-1-ylmethyl)-N-[4-[2-oxo-2-(propan-2-ylamino)ethyl]phenyl]benzamide
CID 55719023
N-[3-(imidazol-1-ylmethyl)phenyl]-3-(piperidin-1-ylmethyl)benzamide
CID 155951666
4-(imidazol-1-ylmethyl)-N-(2-oxo-3-propan-2-yl-1,3-benzothiazol-6-yl)benzamide
CID 100560722
N-(3-ethyl-2-oxo-1,3-benzothiazol-6-yl)-4-(imidazol-1-ylmethyl)benzamide
CID 100548253
N-(2-fluorophenyl)-4-(imidazol-1-ylmethyl)benzamide
CID 43921399
4-(imidazol-1-ylmethyl)-N-propan-2-ylbenzamide
CID 43918416
N-tert-butyl-4-(imidazol-1-ylmethyl)benzamide
CID 43918479

Frequently Asked Questions

What is the IUPAC name of N-(3-acetylphenyl)-4-(imidazol-1-ylmethyl)benzamide?
The IUPAC name of N-(3-acetylphenyl)-4-(imidazol-1-ylmethyl)benzamide (CID 43924465) is N-(3-acetylphenyl)-4-(imidazol-1-ylmethyl)benzamide.
What is the SMILES notation for N-(3-acetylphenyl)-4-(imidazol-1-ylmethyl)benzamide?
The canonical SMILES for N-(3-acetylphenyl)-4-(imidazol-1-ylmethyl)benzamide is CC(=O)c1cccc(NC(=O)c2ccc(Cn3ccnc3)cc2)c1.
What is the InChIKey of N-(3-acetylphenyl)-4-(imidazol-1-ylmethyl)benzamide?
The InChIKey is AVSAJIXJIQPNQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17N3O2/c1-14(23)17-3-2-4-18(11-17)21-19(24)16-7-5-15(6-8-16)12-22-10-9-20-13-22/h2-11,13H,12H2,1H3,(H,21,24).
What are the key properties of N-(3-acetylphenyl)-4-(imidazol-1-ylmethyl)benzamide?
N-(3-acetylphenyl)-4-(imidazol-1-ylmethyl)benzamide has a molecular weight of 319.36 g/mol, XLogP of 3.39, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-acetylphenyl)-4-(imidazol-1-ylmethyl)benzamide is sourced from PubChem (CID 43924465), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).