2-cyclopropyl-2-ethoxy-1-(4-methylcyclohexyl)ethanone

C14H24O2 — CID 116709436

IUPAC2-cyclopropyl-2-ethoxy-1-(4-methylcyclohexyl)ethanone
SMILESCCOC(C(=O)C1CCC(C)CC1)C1CC1
InChIInChI=1S/C14H24O2/c1-3-16-14(12-8-9-12)13(15)11-6-4-10(2)5-7-11/h10-12,14H,3-9H2,1-2H3
InChIKeyLFENNCFHIVCOMP-UHFFFAOYSA-N
MW224.34 g/mol
LogP3.20
Rot. Bonds5

About 2-cyclopropyl-2-ethoxy-1-(4-methylcyclohexyl)ethanone

2-cyclopropyl-2-ethoxy-1-(4-methylcyclohexyl)ethanone (PubChem CID 116709436) has the molecular formula C14H24O2 and a molecular weight of 224.34 g/mol. Its IUPAC name is 2-cyclopropyl-2-ethoxy-1-(4-methylcyclohexyl)ethanone.

Molecular Properties

Compound Name2-cyclopropyl-2-ethoxy-1-(4-methylcyclohexyl)ethanone
PubChem CID116709436
Molecular FormulaC14H24O2
Molecular Weight224.34 g/mol
Exact Mass224.18
IUPAC Name2-cyclopropyl-2-ethoxy-1-(4-methylcyclohexyl)ethanone
SMILESCCOC(C(=O)C1CCC(C)CC1)C1CC1
InChIInChI=1S/C14H24O2/c1-3-16-14(12-8-9-12)13(15)11-6-4-10(2)5-7-11/h10-12,14H,3-9H2,1-2H3
InChIKeyLFENNCFHIVCOMP-UHFFFAOYSA-N
XLogP3.20
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.34
LogP ≤ 53.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 2-cyclopropyl-2-ethoxy-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

Related Compounds

1-cycloheptyl-2-cyclopropyl-2-ethoxyethanone
CID 116709413
1,2-dicyclohexyl-2-ethoxyethanone
CID 70193866
2-ethoxy-3,3-dimethyl-1-(4-methylcyclohexyl)butan-1-one
CID 116710014
1-cyclopropyl-1-ethoxyheptan-2-one
CID 116709315
ethyl 2-(4-methylcyclohexanecarbonyl)pentanoate
CID 83049892
1-cycloheptyl-1-ethoxypentan-2-one
CID 83226001
1-cyclopentyl-2-cyclopropyl-2-methoxyethanone
CID 116709099
4-(2-ethoxy-2-hydroxyacetyl)cyclohexane-1-carboxylic acid
CID 70836224
1-(3,4-dimethylcyclohexyl)-2-ethoxybutan-1-one
CID 116707440
1-cyclohexyl-1-ethoxy-3-ethylpentan-2-one
CID 116751188
2-hydroxy-3,3-dimethyl-1-(4-methylcyclohexyl)butan-1-one
CID 103456257
1-cyclopropyl-1-methoxybutan-2-one
CID 83225361

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-2-ethoxy-1-(4-methylcyclohexyl)ethanone?
The IUPAC name of 2-cyclopropyl-2-ethoxy-1-(4-methylcyclohexyl)ethanone (CID 116709436) is 2-cyclopropyl-2-ethoxy-1-(4-methylcyclohexyl)ethanone.
What is the SMILES notation for 2-cyclopropyl-2-ethoxy-1-(4-methylcyclohexyl)ethanone?
The canonical SMILES for 2-cyclopropyl-2-ethoxy-1-(4-methylcyclohexyl)ethanone is CCOC(C(=O)C1CCC(C)CC1)C1CC1.
What is the InChIKey of 2-cyclopropyl-2-ethoxy-1-(4-methylcyclohexyl)ethanone?
The InChIKey is LFENNCFHIVCOMP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24O2/c1-3-16-14(12-8-9-12)13(15)11-6-4-10(2)5-7-11/h10-12,14H,3-9H2,1-2H3.
What are the key properties of 2-cyclopropyl-2-ethoxy-1-(4-methylcyclohexyl)ethanone?
2-cyclopropyl-2-ethoxy-1-(4-methylcyclohexyl)ethanone has a molecular weight of 224.34 g/mol, XLogP of 3.20, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-2-ethoxy-1-(4-methylcyclohexyl)ethanone is sourced from PubChem (CID 116709436), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).