2-(3,4-dimethylphenyl)-N-[2-(1-hydroxyethyl)-3H-benzimidazol-5-yl]acetamide

C19H21N3O2 — CID 131918595

IUPAC2-(3,4-dimethylphenyl)-N-[2-(1-hydroxyethyl)-3H-benzimidazol-5-yl]acetamide
SMILESCc1ccc(CC(=O)Nc2ccc3nc(C(C)O)[nH]c3c2)cc1C
InChIInChI=1S/C19H21N3O2/c1-11-4-5-14(8-12(11)2)9-18(24)20-15-6-7-16-17(10-15)22-19(21-16)13(3)23/h4-8,10,13,23H,9H2,1-3H3,(H,20,24)(H,21,22)
InChIKeyHINLXMSXVHALTA-UHFFFAOYSA-N
MW323.40 g/mol
LogP3.41
Rot. Bonds4

About 2-(3,4-dimethylphenyl)-N-[2-(1-hydroxyethyl)-3H-benzimidazol-5-yl]acetamide

2-(3,4-dimethylphenyl)-N-[2-(1-hydroxyethyl)-3H-benzimidazol-5-yl]acetamide (PubChem CID 131918595) has the molecular formula C19H21N3O2 and a molecular weight of 323.40 g/mol. Its IUPAC name is 2-(3,4-dimethylphenyl)-N-[2-(1-hydroxyethyl)-3H-benzimidazol-5-yl]acetamide.

Molecular Properties

Compound Name2-(3,4-dimethylphenyl)-N-[2-(1-hydroxyethyl)-3H-benzimidazol-5-yl]acetamide
PubChem CID131918595
Molecular FormulaC19H21N3O2
Molecular Weight323.40 g/mol
Exact Mass323.16
IUPAC Name2-(3,4-dimethylphenyl)-N-[2-(1-hydroxyethyl)-3H-benzimidazol-5-yl]acetamide
SMILESCc1ccc(CC(=O)Nc2ccc3nc(C(C)O)[nH]c3c2)cc1C
InChIInChI=1S/C19H21N3O2/c1-11-4-5-14(8-12(11)2)9-18(24)20-15-6-7-16-17(10-15)22-19(21-16)13(3)23/h4-8,10,13,23H,9H2,1-3H3,(H,20,24)(H,21,22)
InChIKeyHINLXMSXVHALTA-UHFFFAOYSA-N
XLogP3.41
TPSA78.01 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.40
LogP ≤ 53.41
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze 2-(3,4-dimethylphenyl)-N-[2-(1-hydroxyethyl)-3H-benzimidazol-5-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

2-(1,3-benzodioxol-5-yl)-N-[2-(1-hydroxyethyl)-3H-benzimidazol-5-yl]acetamide
CID 131936069
2-cyano-N-[2-(1-hydroxyethyl)-3H-benzimidazol-5-yl]acetamide
CID 168520800
N,2-bis(3,4-dimethylphenyl)acetamide
CID 2600237
N-[2-(1-hydroxyethyl)-3H-benzimidazol-5-yl]-2-piperidin-4-ylacetamide
CID 131891746
N-[2-(1-hydroxyethyl)-3H-benzimidazol-5-yl]-3-pyrazol-1-ylpropanamide
CID 131908353
[2-(1-hydroxyethyl)-3H-benzimidazol-5-yl]thiourea
CID 169356684
N-[2-(1-hydroxyethyl)-3H-benzimidazol-5-yl]-5-(methylsulfanylmethyl)furan-2-carboxamide
CID 131925459
3,4-difluoro-N-[2-(1-hydroxyethyl)-3H-benzimidazol-5-yl]benzamide
CID 131952585
2-(3,4-dimethylphenyl)-N-(4-methylphenyl)acetamide
CID 2664751
N-[2-(1-hydroxyethyl)-3H-benzimidazol-5-yl]-2-(4-oxoquinazolin-3-yl)acetamide
CID 131938928
N-[2-(1-hydroxyethyl)-3H-benzimidazol-5-yl]-5-(2-methylpropyl)-1H-pyrazole-3-carboxamide
CID 131939383
N-(3-amino-4-methylphenyl)-2-(3,4-dimethylphenyl)acetamide
CID 62057767

Frequently Asked Questions

What is the IUPAC name of 2-(3,4-dimethylphenyl)-N-[2-(1-hydroxyethyl)-3H-benzimidazol-5-yl]acetamide?
The IUPAC name of 2-(3,4-dimethylphenyl)-N-[2-(1-hydroxyethyl)-3H-benzimidazol-5-yl]acetamide (CID 131918595) is 2-(3,4-dimethylphenyl)-N-[2-(1-hydroxyethyl)-3H-benzimidazol-5-yl]acetamide.
What is the SMILES notation for 2-(3,4-dimethylphenyl)-N-[2-(1-hydroxyethyl)-3H-benzimidazol-5-yl]acetamide?
The canonical SMILES for 2-(3,4-dimethylphenyl)-N-[2-(1-hydroxyethyl)-3H-benzimidazol-5-yl]acetamide is Cc1ccc(CC(=O)Nc2ccc3nc(C(C)O)[nH]c3c2)cc1C.
What is the InChIKey of 2-(3,4-dimethylphenyl)-N-[2-(1-hydroxyethyl)-3H-benzimidazol-5-yl]acetamide?
The InChIKey is HINLXMSXVHALTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N3O2/c1-11-4-5-14(8-12(11)2)9-18(24)20-15-6-7-16-17(10-15)22-19(21-16)13(3)23/h4-8,10,13,23H,9H2,1-3H3,(H,20,24)(H,21,22).
What are the key properties of 2-(3,4-dimethylphenyl)-N-[2-(1-hydroxyethyl)-3H-benzimidazol-5-yl]acetamide?
2-(3,4-dimethylphenyl)-N-[2-(1-hydroxyethyl)-3H-benzimidazol-5-yl]acetamide has a molecular weight of 323.40 g/mol, XLogP of 3.41, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,4-dimethylphenyl)-N-[2-(1-hydroxyethyl)-3H-benzimidazol-5-yl]acetamide is sourced from PubChem (CID 131918595), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).