2-(2-chlorophenyl)-N-hydroxy-3H-benzimidazole-5-carboxamide

C14H10ClN3O2 — CID 122690291

IUPAC2-(2-chlorophenyl)-N-hydroxy-3H-benzimidazole-5-carboxamide
SMILESO=C(NO)c1ccc2nc(-c3ccccc3Cl)[nH]c2c1
InChIInChI=1S/C14H10ClN3O2/c15-10-4-2-1-3-9(10)13-16-11-6-5-8(14(19)18-20)7-12(11)17-13/h1-7,20H,(H,16,17)(H,18,19)
InChIKeyVPPIXRJWPQEGOQ-UHFFFAOYSA-N
MW287.71 g/mol
LogP3.00
Rot. Bonds2

About 2-(2-chlorophenyl)-N-hydroxy-3H-benzimidazole-5-carboxamide

2-(2-chlorophenyl)-N-hydroxy-3H-benzimidazole-5-carboxamide (PubChem CID 122690291) has the molecular formula C14H10ClN3O2 and a molecular weight of 287.71 g/mol. Its IUPAC name is 2-(2-chlorophenyl)-N-hydroxy-3H-benzimidazole-5-carboxamide.

Molecular Properties

Compound Name2-(2-chlorophenyl)-N-hydroxy-3H-benzimidazole-5-carboxamide
PubChem CID122690291
Molecular FormulaC14H10ClN3O2
Molecular Weight287.71 g/mol
Exact Mass287.05
IUPAC Name2-(2-chlorophenyl)-N-hydroxy-3H-benzimidazole-5-carboxamide
SMILESO=C(NO)c1ccc2nc(-c3ccccc3Cl)[nH]c2c1
InChIInChI=1S/C14H10ClN3O2/c15-10-4-2-1-3-9(10)13-16-11-6-5-8(14(19)18-20)7-12(11)17-13/h1-7,20H,(H,16,17)(H,18,19)
InChIKeyVPPIXRJWPQEGOQ-UHFFFAOYSA-N
XLogP3.00
TPSA78.01 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.71
LogP ≤ 53.00
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydroxamic_acid', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze 2-(2-chlorophenyl)-N-hydroxy-3H-benzimidazole-5-carboxamide 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-hydroxy-2-(2-phenylphenyl)-3H-benzimidazole-5-carboxamide
CID 122690172
N-hydroxy-2-[2-(trifluoromethyl)phenyl]-3H-benzimidazole-5-carboxamide
CID 122690152
2-(2-chlorophenyl)-N-[(E)-(2,4-dichlorophenyl)methylideneamino]-3H-benzimidazole-5-carboxamide
CID 110527081
2-(2-chlorophenyl)-N-[(E)-(4-hydroxyphenyl)methylideneamino]-3H-benzimidazole-5-carboxamide
CID 136781372
6-bromo-2-(2-chlorophenyl)-1H-benzimidazole
CID 64723542
N-hydroxy-2-naphthalen-2-yl-3H-benzimidazole-5-carboxamide
CID 122690256
N-hydroxy-2-(3-phenylphenyl)-3H-benzimidazole-5-carboxamide
CID 122690127
prop-2-enyl 2-(2-chlorophenyl)-3H-benzimidazole-5-carboxylate
CID 91673705
2-[4-(3-chlorophenyl)phenyl]-N-hydroxy-3H-benzimidazole-5-carboxamide
CID 122690329
2-(2,3-dichlorophenyl)-3H-benzimidazole-5-carboxylic acid
CID 43349288
2-[2-(2-ethoxyethoxy)phenyl]-N-hydroxy-3H-benzimidazole-5-carboxamide
CID 122690155
2-(2-chlorophenyl)-N-[(E)-(2,4-dimethoxyphenyl)methylideneamino]-3H-benzimidazole-5-carboxamide
CID 110527100

Frequently Asked Questions

What is the IUPAC name of 2-(2-chlorophenyl)-N-hydroxy-3H-benzimidazole-5-carboxamide?
The IUPAC name of 2-(2-chlorophenyl)-N-hydroxy-3H-benzimidazole-5-carboxamide (CID 122690291) is 2-(2-chlorophenyl)-N-hydroxy-3H-benzimidazole-5-carboxamide.
What is the SMILES notation for 2-(2-chlorophenyl)-N-hydroxy-3H-benzimidazole-5-carboxamide?
The canonical SMILES for 2-(2-chlorophenyl)-N-hydroxy-3H-benzimidazole-5-carboxamide is O=C(NO)c1ccc2nc(-c3ccccc3Cl)[nH]c2c1.
What is the InChIKey of 2-(2-chlorophenyl)-N-hydroxy-3H-benzimidazole-5-carboxamide?
The InChIKey is VPPIXRJWPQEGOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10ClN3O2/c15-10-4-2-1-3-9(10)13-16-11-6-5-8(14(19)18-20)7-12(11)17-13/h1-7,20H,(H,16,17)(H,18,19).
What are the key properties of 2-(2-chlorophenyl)-N-hydroxy-3H-benzimidazole-5-carboxamide?
2-(2-chlorophenyl)-N-hydroxy-3H-benzimidazole-5-carboxamide has a molecular weight of 287.71 g/mol, XLogP of 3.00, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chlorophenyl)-N-hydroxy-3H-benzimidazole-5-carboxamide is sourced from PubChem (CID 122690291), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).