2-chloro-2-(2-chlorophenyl)-N-cyclopentylacetamide

C13H15Cl2NO — CID 62224606

IUPAC2-chloro-2-(2-chlorophenyl)-N-cyclopentylacetamide
SMILESO=C(NC1CCCC1)C(Cl)c1ccccc1Cl
InChIInChI=1S/C13H15Cl2NO/c14-11-8-4-3-7-10(11)12(15)13(17)16-9-5-1-2-6-9/h3-4,7-9,12H,1-2,5-6H2,(H,16,17)
InChIKeyNYTQKHNFTNPKGV-UHFFFAOYSA-N
MW272.17 g/mol
LogP3.68
Rot. Bonds3

About 2-chloro-2-(2-chlorophenyl)-N-cyclopentylacetamide

2-chloro-2-(2-chlorophenyl)-N-cyclopentylacetamide (PubChem CID 62224606) has the molecular formula C13H15Cl2NO and a molecular weight of 272.17 g/mol. Its IUPAC name is 2-chloro-2-(2-chlorophenyl)-N-cyclopentylacetamide.

Molecular Properties

Compound Name2-chloro-2-(2-chlorophenyl)-N-cyclopentylacetamide
PubChem CID62224606
Molecular FormulaC13H15Cl2NO
Molecular Weight272.17 g/mol
Exact Mass271.05
IUPAC Name2-chloro-2-(2-chlorophenyl)-N-cyclopentylacetamide
SMILESO=C(NC1CCCC1)C(Cl)c1ccccc1Cl
InChIInChI=1S/C13H15Cl2NO/c14-11-8-4-3-7-10(11)12(15)13(17)16-9-5-1-2-6-9/h3-4,7-9,12H,1-2,5-6H2,(H,16,17)
InChIKeyNYTQKHNFTNPKGV-UHFFFAOYSA-N
XLogP3.68
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.17
LogP ≤ 53.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'alkyl_halide', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-chloro-2-(2-chlorophenyl)-N-cyclopentylacetamide?
The IUPAC name of 2-chloro-2-(2-chlorophenyl)-N-cyclopentylacetamide (CID 62224606) is 2-chloro-2-(2-chlorophenyl)-N-cyclopentylacetamide.
What is the SMILES notation for 2-chloro-2-(2-chlorophenyl)-N-cyclopentylacetamide?
The canonical SMILES for 2-chloro-2-(2-chlorophenyl)-N-cyclopentylacetamide is O=C(NC1CCCC1)C(Cl)c1ccccc1Cl.
What is the InChIKey of 2-chloro-2-(2-chlorophenyl)-N-cyclopentylacetamide?
The InChIKey is NYTQKHNFTNPKGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15Cl2NO/c14-11-8-4-3-7-10(11)12(15)13(17)16-9-5-1-2-6-9/h3-4,7-9,12H,1-2,5-6H2,(H,16,17).
What are the key properties of 2-chloro-2-(2-chlorophenyl)-N-cyclopentylacetamide?
2-chloro-2-(2-chlorophenyl)-N-cyclopentylacetamide has a molecular weight of 272.17 g/mol, XLogP of 3.68, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-2-(2-chlorophenyl)-N-cyclopentylacetamide is sourced from PubChem (CID 62224606), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).