2-chloro-N-hydroxy-N-(2-methylphenyl)acetamide

C9H10ClNO2 — CID 134890340

IUPAC2-chloro-N-hydroxy-N-(2-methylphenyl)acetamide
SMILESCc1ccccc1N(O)C(=O)CCl
InChIInChI=1S/C9H10ClNO2/c1-7-4-2-3-5-8(7)11(13)9(12)6-10/h2-5,13H,6H2,1H3
InChIKeyDVZKTXUKQMRPGV-UHFFFAOYSA-N
MW199.64 g/mol
LogP1.96
Rot. Bonds2

About 2-chloro-N-hydroxy-N-(2-methylphenyl)acetamide

2-chloro-N-hydroxy-N-(2-methylphenyl)acetamide (PubChem CID 134890340) has the molecular formula C9H10ClNO2 and a molecular weight of 199.64 g/mol. Its IUPAC name is 2-chloro-N-hydroxy-N-(2-methylphenyl)acetamide.

Molecular Properties

Compound Name2-chloro-N-hydroxy-N-(2-methylphenyl)acetamide
PubChem CID134890340
Molecular FormulaC9H10ClNO2
Molecular Weight199.64 g/mol
Exact Mass199.04
IUPAC Name2-chloro-N-hydroxy-N-(2-methylphenyl)acetamide
SMILESCc1ccccc1N(O)C(=O)CCl
InChIInChI=1S/C9H10ClNO2/c1-7-4-2-3-5-8(7)11(13)9(12)6-10/h2-5,13H,6H2,1H3
InChIKeyDVZKTXUKQMRPGV-UHFFFAOYSA-N
XLogP1.96
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.64
LogP ≤ 51.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 2-chloro-N-hydroxy-N-(2-methylphenyl)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-chloro-N-(2-methylphenyl)-N-(thiophen-2-ylmethyl)acetamide
CID 39380130
2-chloro-N-(2-fluorophenyl)-N-[(2-methylphenyl)methyl]acetamide
CID 39398782
N-(4-chloro-3-oxobutyl)-N-(2-methylphenyl)acetamide
CID 104700970
2-amino-N-methyl-N-(2-methylphenyl)acetamide
CID 28794373
2-(dimethylamino)-N-methyl-N-(2-methylphenyl)acetamide
CID 21343400
1,1-bis(2-methylphenyl)urea
CID 3049256
4-(N-hydroxy-2-methylanilino)butan-2-one
CID 14740469
3-amino-N-methyl-N-(2-methylphenyl)propanamide
CID 28794972
2-[(2-chloroacetyl)-[(2-methylphenyl)methyl]amino]acetic acid
CID 166431920
2-chloro-N-(5-chloro-2-methylphenyl)-N-methylacetamide
CID 82082325
2-(2-methyl-N-propylanilino)acetic acid
CID 83559835
2,2-dichloro-N-ethyl-N-(2-methylphenyl)acetamide
CID 3338024

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-hydroxy-N-(2-methylphenyl)acetamide?
The IUPAC name of 2-chloro-N-hydroxy-N-(2-methylphenyl)acetamide (CID 134890340) is 2-chloro-N-hydroxy-N-(2-methylphenyl)acetamide.
What is the SMILES notation for 2-chloro-N-hydroxy-N-(2-methylphenyl)acetamide?
The canonical SMILES for 2-chloro-N-hydroxy-N-(2-methylphenyl)acetamide is Cc1ccccc1N(O)C(=O)CCl.
What is the InChIKey of 2-chloro-N-hydroxy-N-(2-methylphenyl)acetamide?
The InChIKey is DVZKTXUKQMRPGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10ClNO2/c1-7-4-2-3-5-8(7)11(13)9(12)6-10/h2-5,13H,6H2,1H3.
What are the key properties of 2-chloro-N-hydroxy-N-(2-methylphenyl)acetamide?
2-chloro-N-hydroxy-N-(2-methylphenyl)acetamide has a molecular weight of 199.64 g/mol, XLogP of 1.96, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-hydroxy-N-(2-methylphenyl)acetamide is sourced from PubChem (CID 134890340), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).