N-(2-chloro-3H-benzimidazol-5-yl)-2-methoxyacetamide

C10H10ClN3O2 — CID 84581757

IUPACN-(2-chloro-3H-benzimidazol-5-yl)-2-methoxyacetamide
SMILESCOCC(=O)Nc1ccc2nc(Cl)[nH]c2c1
InChIInChI=1S/C10H10ClN3O2/c1-16-5-9(15)12-6-2-3-7-8(4-6)14-10(11)13-7/h2-4H,5H2,1H3,(H,12,15)(H,13,14)
InChIKeyLMYKYCIPYCSZGI-UHFFFAOYSA-N
MW239.66 g/mol
LogP1.80
Rot. Bonds3

About N-(2-chloro-3H-benzimidazol-5-yl)-2-methoxyacetamide

N-(2-chloro-3H-benzimidazol-5-yl)-2-methoxyacetamide (PubChem CID 84581757) has the molecular formula C10H10ClN3O2 and a molecular weight of 239.66 g/mol. Its IUPAC name is N-(2-chloro-3H-benzimidazol-5-yl)-2-methoxyacetamide.

Molecular Properties

Compound NameN-(2-chloro-3H-benzimidazol-5-yl)-2-methoxyacetamide
PubChem CID84581757
Molecular FormulaC10H10ClN3O2
Molecular Weight239.66 g/mol
Exact Mass239.05
IUPAC NameN-(2-chloro-3H-benzimidazol-5-yl)-2-methoxyacetamide
SMILESCOCC(=O)Nc1ccc2nc(Cl)[nH]c2c1
InChIInChI=1S/C10H10ClN3O2/c1-16-5-9(15)12-6-2-3-7-8(4-6)14-10(11)13-7/h2-4H,5H2,1H3,(H,12,15)(H,13,14)
InChIKeyLMYKYCIPYCSZGI-UHFFFAOYSA-N
XLogP1.80
TPSA67.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.66
LogP ≤ 51.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-(2-chloro-3H-benzimidazol-5-yl)-2-methoxyacetamide 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-methoxy-N-(2-pyridin-2-yl-3H-benzimidazol-5-yl)acetamide
CID 56762292
N-(2-chloro-3H-benzimidazol-5-yl)-2-methylpropanamide
CID 84581968
N-(2-chloro-3H-benzimidazol-5-yl)-2,6-dimethoxybenzamide
CID 84579347
N-(2-chloro-3H-benzimidazol-5-yl)-3,4,5-trimethoxybenzamide
CID 84580880
N-(2-chloro-3H-benzimidazol-5-yl)benzamide
CID 84581019
N-(2,3-dioxo-1,4-dihydroquinoxalin-6-yl)-2-methoxyacetamide
CID 60701020
3,4-dichloro-N-(2-chloro-3H-benzimidazol-5-yl)benzamide
CID 84580791
N-(2-chloro-3H-benzimidazol-5-yl)-4-(dimethylamino)benzamide
CID 84582445
2-methoxy-N-(2-methyl-1,3-benzothiazol-6-yl)acetamide
CID 31529238
N-(2-chloro-3H-benzimidazol-5-yl)cyclohexanecarboxamide
CID 84581323
3-chloro-N-(2-methyl-3H-benzimidazol-5-yl)propanamide
CID 43700582
N-[2-(methoxymethyl)-3H-benzimidazol-5-yl]-2-phenylacetamide
CID 51044165

Frequently Asked Questions

What is the IUPAC name of N-(2-chloro-3H-benzimidazol-5-yl)-2-methoxyacetamide?
The IUPAC name of N-(2-chloro-3H-benzimidazol-5-yl)-2-methoxyacetamide (CID 84581757) is N-(2-chloro-3H-benzimidazol-5-yl)-2-methoxyacetamide.
What is the SMILES notation for N-(2-chloro-3H-benzimidazol-5-yl)-2-methoxyacetamide?
The canonical SMILES for N-(2-chloro-3H-benzimidazol-5-yl)-2-methoxyacetamide is COCC(=O)Nc1ccc2nc(Cl)[nH]c2c1.
What is the InChIKey of N-(2-chloro-3H-benzimidazol-5-yl)-2-methoxyacetamide?
The InChIKey is LMYKYCIPYCSZGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10ClN3O2/c1-16-5-9(15)12-6-2-3-7-8(4-6)14-10(11)13-7/h2-4H,5H2,1H3,(H,12,15)(H,13,14).
What are the key properties of N-(2-chloro-3H-benzimidazol-5-yl)-2-methoxyacetamide?
N-(2-chloro-3H-benzimidazol-5-yl)-2-methoxyacetamide has a molecular weight of 239.66 g/mol, XLogP of 1.80, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-chloro-3H-benzimidazol-5-yl)-2-methoxyacetamide is sourced from PubChem (CID 84581757), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).