2-(3,4-dichlorophenyl)-N-[(1S)-2-oxocyclopentyl]acetamide

C13H13Cl2NO2 — CID 130333464

IUPAC2-(3,4-dichlorophenyl)-N-[(1S)-2-oxocyclopentyl]acetamide
SMILESO=C(Cc1ccc(Cl)c(Cl)c1)N[C@H]1CCCC1=O
InChIInChI=1S/C13H13Cl2NO2/c14-9-5-4-8(6-10(9)15)7-13(18)16-11-2-1-3-12(11)17/h4-6,11H,1-3,7H2,(H,16,18)/t11-/m0/s1
InChIKeyIZJYLCOEAHWKNQ-NSHDSACASA-N
MW286.16 g/mol
LogP2.77
Rot. Bonds3

About 2-(3,4-dichlorophenyl)-N-[(1S)-2-oxocyclopentyl]acetamide

2-(3,4-dichlorophenyl)-N-[(1S)-2-oxocyclopentyl]acetamide (PubChem CID 130333464) has the molecular formula C13H13Cl2NO2 and a molecular weight of 286.16 g/mol. Its IUPAC name is 2-(3,4-dichlorophenyl)-N-[(1S)-2-oxocyclopentyl]acetamide.

Molecular Properties

Compound Name2-(3,4-dichlorophenyl)-N-[(1S)-2-oxocyclopentyl]acetamide
PubChem CID130333464
Molecular FormulaC13H13Cl2NO2
Molecular Weight286.16 g/mol
Exact Mass285.03
IUPAC Name2-(3,4-dichlorophenyl)-N-[(1S)-2-oxocyclopentyl]acetamide
SMILESO=C(Cc1ccc(Cl)c(Cl)c1)N[C@H]1CCCC1=O
InChIInChI=1S/C13H13Cl2NO2/c14-9-5-4-8(6-10(9)15)7-13(18)16-11-2-1-3-12(11)17/h4-6,11H,1-3,7H2,(H,16,18)/t11-/m0/s1
InChIKeyIZJYLCOEAHWKNQ-NSHDSACASA-N
XLogP2.77
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.16
LogP ≤ 52.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-(3,4-dichlorophenyl)-N-[(1S)-2-oxocyclopentyl]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-(2-chlorophenyl)-N-[(1R)-2-oxocyclopentyl]acetamide
CID 58413586
2-(4-methylphenyl)-N-[(1R)-2-oxocyclopentyl]acetamide
CID 58413553
N-cyclopropyl-2-(3,4-dichlorophenyl)acetamide
CID 2682748
N-cyclohexyl-2-(3,4-dichlorophenyl)acetamide
CID 2557208
2-(4-nitrophenyl)-N-[(1R)-2-oxocyclopentyl]acetamide
CID 58413628
2-(2-bromophenyl)-N-[(1R)-2-oxocyclopentyl]acetamide
CID 58413596
N-[2-(bromomethyl)cyclohexyl]-2-(3,4-dichlorophenyl)acetamide
CID 106367187
2-(3,4-dichlorophenyl)-N-(2,3-dimethylcyclohexyl)acetamide
CID 18206629
2-(3,4-dichlorophenyl)-N-(1-ethylpiperidin-4-yl)acetamide
CID 17173850
2-cyclopropyl-2-[[2-(3,4-dichlorophenyl)acetyl]amino]acetic acid
CID 62697078
2-(3,4-dichlorophenyl)-N-(2-pyrrolidin-1-ylcyclohexyl)acetamide
CID 18930457
2-(3,4-dichlorophenyl)-N-methyl-N-[(1S,2R)-3-oxo-2-pyrrolidin-1-ylcyclohexyl]acetamide
CID 22827143

Frequently Asked Questions

What is the IUPAC name of 2-(3,4-dichlorophenyl)-N-[(1S)-2-oxocyclopentyl]acetamide?
The IUPAC name of 2-(3,4-dichlorophenyl)-N-[(1S)-2-oxocyclopentyl]acetamide (CID 130333464) is 2-(3,4-dichlorophenyl)-N-[(1S)-2-oxocyclopentyl]acetamide.
What is the SMILES notation for 2-(3,4-dichlorophenyl)-N-[(1S)-2-oxocyclopentyl]acetamide?
The canonical SMILES for 2-(3,4-dichlorophenyl)-N-[(1S)-2-oxocyclopentyl]acetamide is O=C(Cc1ccc(Cl)c(Cl)c1)N[C@H]1CCCC1=O.
What is the InChIKey of 2-(3,4-dichlorophenyl)-N-[(1S)-2-oxocyclopentyl]acetamide?
The InChIKey is IZJYLCOEAHWKNQ-NSHDSACASA-N. The full InChI is InChI=1S/C13H13Cl2NO2/c14-9-5-4-8(6-10(9)15)7-13(18)16-11-2-1-3-12(11)17/h4-6,11H,1-3,7H2,(H,16,18)/t11-/m0/s1.
What are the key properties of 2-(3,4-dichlorophenyl)-N-[(1S)-2-oxocyclopentyl]acetamide?
2-(3,4-dichlorophenyl)-N-[(1S)-2-oxocyclopentyl]acetamide has a molecular weight of 286.16 g/mol, XLogP of 2.77, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,4-dichlorophenyl)-N-[(1S)-2-oxocyclopentyl]acetamide is sourced from PubChem (CID 130333464), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).