N-[2-(chloromethyl)cyclopentyl]butanamide

C10H18ClNO — CID 106365880

IUPACN-[2-(chloromethyl)cyclopentyl]butanamide
SMILESCCCC(=O)NC1CCCC1CCl
InChIInChI=1S/C10H18ClNO/c1-2-4-10(13)12-9-6-3-5-8(9)7-11/h8-9H,2-7H2,1H3,(H,12,13)
InChIKeyFXJYXSOKKOPZNT-UHFFFAOYSA-N
MW203.71 g/mol
LogP2.31
Rot. Bonds4

About N-[2-(chloromethyl)cyclopentyl]butanamide

N-[2-(chloromethyl)cyclopentyl]butanamide (PubChem CID 106365880) has the molecular formula C10H18ClNO and a molecular weight of 203.71 g/mol. Its IUPAC name is N-[2-(chloromethyl)cyclopentyl]butanamide.

Molecular Properties

Compound NameN-[2-(chloromethyl)cyclopentyl]butanamide
PubChem CID106365880
Molecular FormulaC10H18ClNO
Molecular Weight203.71 g/mol
Exact Mass203.11
IUPAC NameN-[2-(chloromethyl)cyclopentyl]butanamide
SMILESCCCC(=O)NC1CCCC1CCl
InChIInChI=1S/C10H18ClNO/c1-2-4-10(13)12-9-6-3-5-8(9)7-11/h8-9H,2-7H2,1H3,(H,12,13)
InChIKeyFXJYXSOKKOPZNT-UHFFFAOYSA-N
XLogP2.31
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.71
LogP ≤ 52.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze N-[2-(chloromethyl)cyclopentyl]butanamide 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

N-[2-(chloromethyl)cyclopentyl]nonanamide
CID 114179441
N-[2-(chloromethyl)cyclopentyl]-3-methylpentanamide
CID 106366056
N-[2-(chloromethyl)cyclopentyl]-2-cyclopropylacetamide
CID 106365797
N-(2-hydroxycyclopentyl)butanamide
CID 72951810
N-[(1S,2S)-2-hydroxycyclopentyl]butanamide;hydrochloride
CID 71419667
N-[2-(chloromethyl)cyclohexyl]-2-methylsulfanylacetamide
CID 106366717
N-[2-(chloromethyl)cyclohexyl]-2-cyclopentylacetamide
CID 106366838
N-[2-(aminomethyl)cyclopentyl]pentanamide
CID 62957090
N-(2-methylcyclohexyl)butanamide
CID 47005567
N-[2-(hydroxymethyl)cyclopentyl]nonanamide
CID 103774038
N-[2-(chloromethyl)cyclohexyl]cyclobutanecarboxamide
CID 106366933
N-[2-(chloromethyl)cyclopentyl]-2-methylcyclopropane-1-carboxamide
CID 106366126

Frequently Asked Questions

What is the IUPAC name of N-[2-(chloromethyl)cyclopentyl]butanamide?
The IUPAC name of N-[2-(chloromethyl)cyclopentyl]butanamide (CID 106365880) is N-[2-(chloromethyl)cyclopentyl]butanamide.
What is the SMILES notation for N-[2-(chloromethyl)cyclopentyl]butanamide?
The canonical SMILES for N-[2-(chloromethyl)cyclopentyl]butanamide is CCCC(=O)NC1CCCC1CCl.
What is the InChIKey of N-[2-(chloromethyl)cyclopentyl]butanamide?
The InChIKey is FXJYXSOKKOPZNT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18ClNO/c1-2-4-10(13)12-9-6-3-5-8(9)7-11/h8-9H,2-7H2,1H3,(H,12,13).
What are the key properties of N-[2-(chloromethyl)cyclopentyl]butanamide?
N-[2-(chloromethyl)cyclopentyl]butanamide has a molecular weight of 203.71 g/mol, XLogP of 2.31, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(chloromethyl)cyclopentyl]butanamide is sourced from PubChem (CID 106365880), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).