2-(4-chlorophenyl)-N,2-dihydroxy-N-methylpropanamide

C10H12ClNO3 — CID 14787850

IUPAC2-(4-chlorophenyl)-N,2-dihydroxy-N-methylpropanamide
SMILESCN(O)C(=O)C(C)(O)c1ccc(Cl)cc1
InChIInChI=1S/C10H12ClNO3/c1-10(14,9(13)12(2)15)7-3-5-8(11)6-4-7/h3-6,14-15H,1-2H3
InChIKeyOUEDHMTUFHEECB-UHFFFAOYSA-N
MW229.66 g/mol
LogP1.40
Rot. Bonds2

About 2-(4-chlorophenyl)-N,2-dihydroxy-N-methylpropanamide

2-(4-chlorophenyl)-N,2-dihydroxy-N-methylpropanamide (PubChem CID 14787850) has the molecular formula C10H12ClNO3 and a molecular weight of 229.66 g/mol. Its IUPAC name is 2-(4-chlorophenyl)-N,2-dihydroxy-N-methylpropanamide.

Molecular Properties

Compound Name2-(4-chlorophenyl)-N,2-dihydroxy-N-methylpropanamide
PubChem CID14787850
Molecular FormulaC10H12ClNO3
Molecular Weight229.66 g/mol
Exact Mass229.05
IUPAC Name2-(4-chlorophenyl)-N,2-dihydroxy-N-methylpropanamide
SMILESCN(O)C(=O)C(C)(O)c1ccc(Cl)cc1
InChIInChI=1S/C10H12ClNO3/c1-10(14,9(13)12(2)15)7-3-5-8(11)6-4-7/h3-6,14-15H,1-2H3
InChIKeyOUEDHMTUFHEECB-UHFFFAOYSA-N
XLogP1.40
TPSA60.77 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.66
LogP ≤ 51.40
H-Bond Donors ≤ 52
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-(4-chlorophenyl)-N,2-dihydroxy-N-methylpropanamide 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-(3-Chlorophenyl)-2-hydroxynonanamide
CID 10039502
(2S)-2-(3-chlorophenyl)-2-hydroxynonanamide
CID 24883321
(2R)-2-(3-chlorophenyl)-2-hydroxynonanamide
CID 24883322
2-(3-Chlorophenyl)-2-hydroxynon-8-enamide
CID 70682599
2-(3-Chlorophenyl)-2-hydroxy-5,9-dimethyldec-8-enamide
CID 70693132
(4E)-2-(3-chlorophenyl)-2-hydroxy-5,9-dimethyldeca-4,8-dienamide
CID 70697237
3-(4-chlorophenyl)-N,3-dihydroxy-N-methylpropanamide
CID 155536133
2-(3,4-Dichlorophenyl)-2-hydroxybutanamide
CID 10285982
2-(3,4-Dichlorophenyl)-2-hydroxyhexanamide
CID 11460060
2-(4-Chlorophenyl)-3,3,3-trifluoro-2-hydroxypropanamide
CID 21024130
2-(4-Chloro-2-fluorophenyl)-2-hydroxy-2-phenylacetamide
CID 140016714
2-(4-Chloro-3-fluorophenyl)-2-hydroxy-2-phenylacetamide
CID 140163364

Frequently Asked Questions

What is the IUPAC name of 2-(4-chlorophenyl)-N,2-dihydroxy-N-methylpropanamide?
The IUPAC name of 2-(4-chlorophenyl)-N,2-dihydroxy-N-methylpropanamide (CID 14787850) is 2-(4-chlorophenyl)-N,2-dihydroxy-N-methylpropanamide.
What is the SMILES notation for 2-(4-chlorophenyl)-N,2-dihydroxy-N-methylpropanamide?
The canonical SMILES for 2-(4-chlorophenyl)-N,2-dihydroxy-N-methylpropanamide is CN(O)C(=O)C(C)(O)c1ccc(Cl)cc1.
What is the InChIKey of 2-(4-chlorophenyl)-N,2-dihydroxy-N-methylpropanamide?
The InChIKey is OUEDHMTUFHEECB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12ClNO3/c1-10(14,9(13)12(2)15)7-3-5-8(11)6-4-7/h3-6,14-15H,1-2H3.
What are the key properties of 2-(4-chlorophenyl)-N,2-dihydroxy-N-methylpropanamide?
2-(4-chlorophenyl)-N,2-dihydroxy-N-methylpropanamide has a molecular weight of 229.66 g/mol, XLogP of 1.40, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chlorophenyl)-N,2-dihydroxy-N-methylpropanamide is sourced from PubChem (CID 14787850), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).