N-(2,3-dimethylphenyl)-2-(1-methylimidazol-2-yl)acetamide

C14H17N3O — CID 110474610

IUPACN-(2,3-dimethylphenyl)-2-(1-methylimidazol-2-yl)acetamide
SMILESCc1cccc(NC(=O)Cc2nccn2C)c1C
InChIInChI=1S/C14H17N3O/c1-10-5-4-6-12(11(10)2)16-14(18)9-13-15-7-8-17(13)3/h4-8H,9H2,1-3H3,(H,16,18)
InChIKeyIQSAQHZHVZUANF-UHFFFAOYSA-N
MW243.31 g/mol
LogP2.22
Rot. Bonds3

About N-(2,3-dimethylphenyl)-2-(1-methylimidazol-2-yl)acetamide

N-(2,3-dimethylphenyl)-2-(1-methylimidazol-2-yl)acetamide (PubChem CID 110474610) has the molecular formula C14H17N3O and a molecular weight of 243.31 g/mol. Its IUPAC name is N-(2,3-dimethylphenyl)-2-(1-methylimidazol-2-yl)acetamide.

Molecular Properties

Compound NameN-(2,3-dimethylphenyl)-2-(1-methylimidazol-2-yl)acetamide
PubChem CID110474610
Molecular FormulaC14H17N3O
Molecular Weight243.31 g/mol
Exact Mass243.14
IUPAC NameN-(2,3-dimethylphenyl)-2-(1-methylimidazol-2-yl)acetamide
SMILESCc1cccc(NC(=O)Cc2nccn2C)c1C
InChIInChI=1S/C14H17N3O/c1-10-5-4-6-12(11(10)2)16-14(18)9-13-15-7-8-17(13)3/h4-8H,9H2,1-3H3,(H,16,18)
InChIKeyIQSAQHZHVZUANF-UHFFFAOYSA-N
XLogP2.22
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.31
LogP ≤ 52.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-(2,3-dimethylphenyl)-2-(1-methylimidazol-2-yl)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-(3,4-dimethylphenyl)-2-(1-methylimidazol-2-yl)acetamide
CID 110474605
N-(2,3-dimethylphenyl)-2-pyridin-2-ylacetamide
CID 110696972
2,3-dimethyl-N-[2-(1-methylimidazol-2-yl)ethyl]aniline
CID 114527496
N-(3-amino-2-methylphenyl)-2-[methyl-[(1-methylimidazol-2-yl)methyl]amino]acetamide
CID 63015483
N,N'-bis(2,3-dimethylphenyl)butanediamide
CID 4250073
N-(2,3-dimethylphenyl)-3-imidazol-1-ylpropanamide
CID 46339273
N-(2,3-dimethylphenyl)-2-hydroxyacetamide
CID 16769655
N-(2,3-dimethylphenyl)-2-[2-(1-methylimidazol-2-yl)piperazin-1-yl]acetamide
CID 120869970
N-(2,3-dimethylphenyl)-2-(4-methyl-1,3-thiazol-2-yl)acetamide
CID 110484536
2-(1-methylimidazol-2-yl)-N-(4-propan-2-ylphenyl)acetamide
CID 110474647
2-(1-methylimidazol-2-yl)-N-(4-methyl-1,3-thiazol-2-yl)acetamide
CID 110474589
N-(2-bromophenyl)-2-[(1-methylimidazol-2-yl)methylamino]acetamide
CID 60694560

Frequently Asked Questions

What is the IUPAC name of N-(2,3-dimethylphenyl)-2-(1-methylimidazol-2-yl)acetamide?
The IUPAC name of N-(2,3-dimethylphenyl)-2-(1-methylimidazol-2-yl)acetamide (CID 110474610) is N-(2,3-dimethylphenyl)-2-(1-methylimidazol-2-yl)acetamide.
What is the SMILES notation for N-(2,3-dimethylphenyl)-2-(1-methylimidazol-2-yl)acetamide?
The canonical SMILES for N-(2,3-dimethylphenyl)-2-(1-methylimidazol-2-yl)acetamide is Cc1cccc(NC(=O)Cc2nccn2C)c1C.
What is the InChIKey of N-(2,3-dimethylphenyl)-2-(1-methylimidazol-2-yl)acetamide?
The InChIKey is IQSAQHZHVZUANF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3O/c1-10-5-4-6-12(11(10)2)16-14(18)9-13-15-7-8-17(13)3/h4-8H,9H2,1-3H3,(H,16,18).
What are the key properties of N-(2,3-dimethylphenyl)-2-(1-methylimidazol-2-yl)acetamide?
N-(2,3-dimethylphenyl)-2-(1-methylimidazol-2-yl)acetamide has a molecular weight of 243.31 g/mol, XLogP of 2.22, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dimethylphenyl)-2-(1-methylimidazol-2-yl)acetamide is sourced from PubChem (CID 110474610), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).