N-[1-(2-chloroacetyl)cyclopentyl]acetamide

C9H14ClNO2 — CID 104701020

IUPACN-[1-(2-chloroacetyl)cyclopentyl]acetamide
SMILESCC(=O)NC1(C(=O)CCl)CCCC1
InChIInChI=1S/C9H14ClNO2/c1-7(12)11-9(8(13)6-10)4-2-3-5-9/h2-6H2,1H3,(H,11,12)
InChIKeyWFXBLWBVLOYGLR-UHFFFAOYSA-N
MW203.67 g/mol
LogP1.24
Rot. Bonds3

About N-[1-(2-chloroacetyl)cyclopentyl]acetamide

N-[1-(2-chloroacetyl)cyclopentyl]acetamide (PubChem CID 104701020) has the molecular formula C9H14ClNO2 and a molecular weight of 203.67 g/mol. Its IUPAC name is N-[1-(2-chloroacetyl)cyclopentyl]acetamide.

Molecular Properties

Compound NameN-[1-(2-chloroacetyl)cyclopentyl]acetamide
PubChem CID104701020
Molecular FormulaC9H14ClNO2
Molecular Weight203.67 g/mol
Exact Mass203.07
IUPAC NameN-[1-(2-chloroacetyl)cyclopentyl]acetamide
SMILESCC(=O)NC1(C(=O)CCl)CCCC1
InChIInChI=1S/C9H14ClNO2/c1-7(12)11-9(8(13)6-10)4-2-3-5-9/h2-6H2,1H3,(H,11,12)
InChIKeyWFXBLWBVLOYGLR-UHFFFAOYSA-N
XLogP1.24
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.67
LogP ≤ 51.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-[1-(2-chloroacetyl)cyclobutyl]acetamide
CID 104701673
N-[1-(2-chloroacetyl)cyclopentyl]-2,2,2-trifluoroacetamide
CID 104701012
N-[1-(2-chloroacetyl)cyclohexyl]-2,2-difluoroacetamide
CID 103516236
N-(1-acetylcyclobutyl)acetamide
CID 59658507
1-acetamidocyclobutane-1-carboxamide
CID 58720910
N-[[1-(2-chloroacetyl)cycloheptyl]methyl]acetamide
CID 104701757
N-[1-(2-chloroacetyl)cyclopropyl]-2,2-difluoroacetamide
CID 103516289
1-acetamido-N-(2-methylpropyl)cyclohexane-1-carboxamide
CID 47345134
1-acetamido-N-butan-2-ylcyclohexane-1-carboxamide
CID 47345116
1-[(2-chloroacetyl)amino]cyclopentane-1-carboxamide
CID 130608806
8-acetamidospiro[4.5]decane-8-carboxylic acid
CID 114818426
propyl N-[1-(2-chloroacetyl)-4-methylcyclohexyl]carbamate
CID 112738913

Frequently Asked Questions

What is the IUPAC name of N-[1-(2-chloroacetyl)cyclopentyl]acetamide?
The IUPAC name of N-[1-(2-chloroacetyl)cyclopentyl]acetamide (CID 104701020) is N-[1-(2-chloroacetyl)cyclopentyl]acetamide.
What is the SMILES notation for N-[1-(2-chloroacetyl)cyclopentyl]acetamide?
The canonical SMILES for N-[1-(2-chloroacetyl)cyclopentyl]acetamide is CC(=O)NC1(C(=O)CCl)CCCC1.
What is the InChIKey of N-[1-(2-chloroacetyl)cyclopentyl]acetamide?
The InChIKey is WFXBLWBVLOYGLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14ClNO2/c1-7(12)11-9(8(13)6-10)4-2-3-5-9/h2-6H2,1H3,(H,11,12).
What are the key properties of N-[1-(2-chloroacetyl)cyclopentyl]acetamide?
N-[1-(2-chloroacetyl)cyclopentyl]acetamide has a molecular weight of 203.67 g/mol, XLogP of 1.24, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(2-chloroacetyl)cyclopentyl]acetamide is sourced from PubChem (CID 104701020), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).