4-[2-cyclobutylethyl(methyl)amino]cyclohexan-1-one

C13H23NO — CID 117039789

IUPAC4-[2-cyclobutylethyl(methyl)amino]cyclohexan-1-one
SMILESCN(CCC1CCC1)C1CCC(=O)CC1
InChIInChI=1S/C13H23NO/c1-14(10-9-11-3-2-4-11)12-5-7-13(15)8-6-12/h11-12H,2-10H2,1H3
InChIKeyOUGAPDWXDKCFND-UHFFFAOYSA-N
MW209.33 g/mol
LogP2.62
Rot. Bonds4

About 4-[2-cyclobutylethyl(methyl)amino]cyclohexan-1-one

4-[2-cyclobutylethyl(methyl)amino]cyclohexan-1-one (PubChem CID 117039789) has the molecular formula C13H23NO and a molecular weight of 209.33 g/mol. Its IUPAC name is 4-[2-cyclobutylethyl(methyl)amino]cyclohexan-1-one.

Molecular Properties

Compound Name4-[2-cyclobutylethyl(methyl)amino]cyclohexan-1-one
PubChem CID117039789
Molecular FormulaC13H23NO
Molecular Weight209.33 g/mol
Exact Mass209.18
IUPAC Name4-[2-cyclobutylethyl(methyl)amino]cyclohexan-1-one
SMILESCN(CCC1CCC1)C1CCC(=O)CC1
InChIInChI=1S/C13H23NO/c1-14(10-9-11-3-2-4-11)12-5-7-13(15)8-6-12/h11-12H,2-10H2,1H3
InChIKeyOUGAPDWXDKCFND-UHFFFAOYSA-N
XLogP2.62
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.33
LogP ≤ 52.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 4-[2-cyclobutylethyl(methyl)amino]cyclohexan-1-one 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

4-[3-hydroxypropyl(methyl)amino]cyclohexan-1-one
CID 79120512
4-[decyl(methyl)amino]cyclohexan-1-one
CID 79120098
4-[but-3-ynyl(methyl)amino]cyclohexan-1-one
CID 79119767
4-[2-cyclohexylethyl(methyl)amino]cyclohexan-1-ol
CID 115149623
4-[(2-hydroxy-2-methylpropyl)-methylamino]cyclohexan-1-one
CID 79120099
4-[methyl(2-propoxyethyl)amino]cyclohexan-1-one
CID 106452882
4-[cyclohexyl(methyl)amino]cyclohexan-1-one
CID 79119763
4-[2-(4-ethylphenyl)ethyl-methylamino]cyclohexan-1-one
CID 117039757
4-[2-(2-methoxyethoxy)ethyl-methylamino]cyclohexan-1-one
CID 79120597
N-methyl-3-[methyl-(4-oxocyclohexyl)amino]propanamide
CID 79120336
4-[methyl(2-morpholin-4-ylethyl)amino]cyclohexan-1-one
CID 79120517
4-[cyclohexyl(ethyl)amino]cyclohexan-1-one
CID 114761997

Frequently Asked Questions

What is the IUPAC name of 4-[2-cyclobutylethyl(methyl)amino]cyclohexan-1-one?
The IUPAC name of 4-[2-cyclobutylethyl(methyl)amino]cyclohexan-1-one (CID 117039789) is 4-[2-cyclobutylethyl(methyl)amino]cyclohexan-1-one.
What is the SMILES notation for 4-[2-cyclobutylethyl(methyl)amino]cyclohexan-1-one?
The canonical SMILES for 4-[2-cyclobutylethyl(methyl)amino]cyclohexan-1-one is CN(CCC1CCC1)C1CCC(=O)CC1.
What is the InChIKey of 4-[2-cyclobutylethyl(methyl)amino]cyclohexan-1-one?
The InChIKey is OUGAPDWXDKCFND-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23NO/c1-14(10-9-11-3-2-4-11)12-5-7-13(15)8-6-12/h11-12H,2-10H2,1H3.
What are the key properties of 4-[2-cyclobutylethyl(methyl)amino]cyclohexan-1-one?
4-[2-cyclobutylethyl(methyl)amino]cyclohexan-1-one has a molecular weight of 209.33 g/mol, XLogP of 2.62, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-cyclobutylethyl(methyl)amino]cyclohexan-1-one is sourced from PubChem (CID 117039789), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).