2-cyclopentyl-1-(4-methylcyclohexyl)ethanone

C14H24O — CID 62621954

IUPAC2-cyclopentyl-1-(4-methylcyclohexyl)ethanone
SMILESCC1CCC(C(=O)CC2CCCC2)CC1
InChIInChI=1S/C14H24O/c1-11-6-8-13(9-7-11)14(15)10-12-4-2-3-5-12/h11-13H,2-10H2,1H3
InChIKeyLDCHKOJRFKFJEZ-UHFFFAOYSA-N
MW208.34 g/mol
LogP3.96
Rot. Bonds3

About 2-cyclopentyl-1-(4-methylcyclohexyl)ethanone

2-cyclopentyl-1-(4-methylcyclohexyl)ethanone (PubChem CID 62621954) has the molecular formula C14H24O and a molecular weight of 208.34 g/mol. Its IUPAC name is 2-cyclopentyl-1-(4-methylcyclohexyl)ethanone.

Molecular Properties

Compound Name2-cyclopentyl-1-(4-methylcyclohexyl)ethanone
PubChem CID62621954
Molecular FormulaC14H24O
Molecular Weight208.34 g/mol
Exact Mass208.18
IUPAC Name2-cyclopentyl-1-(4-methylcyclohexyl)ethanone
SMILESCC1CCC(C(=O)CC2CCCC2)CC1
InChIInChI=1S/C14H24O/c1-11-6-8-13(9-7-11)14(15)10-12-4-2-3-5-12/h11-13H,2-10H2,1H3
InChIKeyLDCHKOJRFKFJEZ-UHFFFAOYSA-N
XLogP3.96
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.34
LogP ≤ 53.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 2-cyclopentyl-1-(4-methylcyclohexyl)ethanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-cyclopentyl-1-(4-methylcyclohexyl)ethanone?
The IUPAC name of 2-cyclopentyl-1-(4-methylcyclohexyl)ethanone (CID 62621954) is 2-cyclopentyl-1-(4-methylcyclohexyl)ethanone.
What is the SMILES notation for 2-cyclopentyl-1-(4-methylcyclohexyl)ethanone?
The canonical SMILES for 2-cyclopentyl-1-(4-methylcyclohexyl)ethanone is CC1CCC(C(=O)CC2CCCC2)CC1.
What is the InChIKey of 2-cyclopentyl-1-(4-methylcyclohexyl)ethanone?
The InChIKey is LDCHKOJRFKFJEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24O/c1-11-6-8-13(9-7-11)14(15)10-12-4-2-3-5-12/h11-13H,2-10H2,1H3.
What are the key properties of 2-cyclopentyl-1-(4-methylcyclohexyl)ethanone?
2-cyclopentyl-1-(4-methylcyclohexyl)ethanone has a molecular weight of 208.34 g/mol, XLogP of 3.96, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopentyl-1-(4-methylcyclohexyl)ethanone is sourced from PubChem (CID 62621954), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).