2-(2-acetylimidazol-1-yl)-N-[2-(2-methylphenyl)ethyl]acetamide

C16H19N3O2 — CID 99802796

IUPAC2-(2-acetylimidazol-1-yl)-N-[2-(2-methylphenyl)ethyl]acetamide
SMILESCC(=O)c1nccn1CC(=O)NCCc1ccccc1C
InChIInChI=1S/C16H19N3O2/c1-12-5-3-4-6-14(12)7-8-17-15(21)11-19-10-9-18-16(19)13(2)20/h3-6,9-10H,7-8,11H2,1-2H3,(H,17,21)
InChIKeyCSRCMIJRYNZZBW-UHFFFAOYSA-N
MW285.35 g/mol
LogP1.75
Rot. Bonds6

About 2-(2-acetylimidazol-1-yl)-N-[2-(2-methylphenyl)ethyl]acetamide

2-(2-acetylimidazol-1-yl)-N-[2-(2-methylphenyl)ethyl]acetamide (PubChem CID 99802796) has the molecular formula C16H19N3O2 and a molecular weight of 285.35 g/mol. Its IUPAC name is 2-(2-acetylimidazol-1-yl)-N-[2-(2-methylphenyl)ethyl]acetamide.

Molecular Properties

Compound Name2-(2-acetylimidazol-1-yl)-N-[2-(2-methylphenyl)ethyl]acetamide
PubChem CID99802796
Molecular FormulaC16H19N3O2
Molecular Weight285.35 g/mol
Exact Mass285.15
IUPAC Name2-(2-acetylimidazol-1-yl)-N-[2-(2-methylphenyl)ethyl]acetamide
SMILESCC(=O)c1nccn1CC(=O)NCCc1ccccc1C
InChIInChI=1S/C16H19N3O2/c1-12-5-3-4-6-14(12)7-8-17-15(21)11-19-10-9-18-16(19)13(2)20/h3-6,9-10H,7-8,11H2,1-2H3,(H,17,21)
InChIKeyCSRCMIJRYNZZBW-UHFFFAOYSA-N
XLogP1.75
TPSA63.99 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.35
LogP ≤ 51.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-(2-acetylimidazol-1-yl)-N-[2-(2-methylphenyl)ethyl]acetamide 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-[2-(2-methylphenyl)ethyl]-2-(2-oxo-1-pyridinyl)acetamide
CID 51177305
2-(4-amino-3,5-dimethylpyrazol-1-yl)-N-[2-(2-methylphenyl)ethyl]acetamide
CID 79756144
2-(ethylamino)-N-[2-(2-methylphenyl)ethyl]acetamide
CID 78912717
3-indol-1-yl-N-[2-(2-methylphenyl)ethyl]propanamide
CID 18114637
5-[2-(2-methylphenyl)ethylamino]-5-oxopentanoic acid
CID 78911171
3-(2-methylphenyl)-1-(1-propylimidazol-2-yl)propan-1-one
CID 105100680
2-[4-(2-hydroxyethyl)piperazin-1-yl]-N-[2-(2-methylphenyl)ethyl]acetamide
CID 47010786
N-[2-(2-methylphenyl)ethyl]-3-sulfanylpropanamide
CID 107032245
N-[2-(2-methylphenyl)ethyl]-2-(12-oxo-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9-trien-11-yl)acetamide
CID 8576911
2-[2-(2-methylphenyl)ethylamino]-N-propylacetamide
CID 112722399
N-[2-(2-methylphenyl)ethyl]-2-(3-oxo-8-thia-4,6-diazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),5-trien-4-yl)acetamide
CID 112795644
2-[4-(methanesulfonamido)triazol-2-yl]-N-[2-(2-methylphenyl)ethyl]acetamide
CID 112529256

Frequently Asked Questions

What is the IUPAC name of 2-(2-acetylimidazol-1-yl)-N-[2-(2-methylphenyl)ethyl]acetamide?
The IUPAC name of 2-(2-acetylimidazol-1-yl)-N-[2-(2-methylphenyl)ethyl]acetamide (CID 99802796) is 2-(2-acetylimidazol-1-yl)-N-[2-(2-methylphenyl)ethyl]acetamide.
What is the SMILES notation for 2-(2-acetylimidazol-1-yl)-N-[2-(2-methylphenyl)ethyl]acetamide?
The canonical SMILES for 2-(2-acetylimidazol-1-yl)-N-[2-(2-methylphenyl)ethyl]acetamide is CC(=O)c1nccn1CC(=O)NCCc1ccccc1C.
What is the InChIKey of 2-(2-acetylimidazol-1-yl)-N-[2-(2-methylphenyl)ethyl]acetamide?
The InChIKey is CSRCMIJRYNZZBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3O2/c1-12-5-3-4-6-14(12)7-8-17-15(21)11-19-10-9-18-16(19)13(2)20/h3-6,9-10H,7-8,11H2,1-2H3,(H,17,21).
What are the key properties of 2-(2-acetylimidazol-1-yl)-N-[2-(2-methylphenyl)ethyl]acetamide?
2-(2-acetylimidazol-1-yl)-N-[2-(2-methylphenyl)ethyl]acetamide has a molecular weight of 285.35 g/mol, XLogP of 1.75, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-acetylimidazol-1-yl)-N-[2-(2-methylphenyl)ethyl]acetamide is sourced from PubChem (CID 99802796), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).