5-cyclohexyloxycyclohex-3-en-1-amine

C12H21NO — CID 89073915

IUPAC5-cyclohexyloxycyclohex-3-en-1-amine
SMILESNC1CC=CC(OC2CCCCC2)C1
InChIInChI=1S/C12H21NO/c13-10-5-4-8-12(9-10)14-11-6-2-1-3-7-11/h4,8,10-12H,1-3,5-7,9,13H2
InChIKeyLWOJOEZHMQHFDG-UHFFFAOYSA-N
MW195.31 g/mol
LogP2.38
Rot. Bonds2

About 5-cyclohexyloxycyclohex-3-en-1-amine

5-cyclohexyloxycyclohex-3-en-1-amine (PubChem CID 89073915) has the molecular formula C12H21NO and a molecular weight of 195.31 g/mol. Its IUPAC name is 5-cyclohexyloxycyclohex-3-en-1-amine.

Molecular Properties

Compound Name5-cyclohexyloxycyclohex-3-en-1-amine
PubChem CID89073915
Molecular FormulaC12H21NO
Molecular Weight195.31 g/mol
Exact Mass195.16
IUPAC Name5-cyclohexyloxycyclohex-3-en-1-amine
SMILESNC1CC=CC(OC2CCCCC2)C1
InChIInChI=1S/C12H21NO/c13-10-5-4-8-12(9-10)14-11-6-2-1-3-7-11/h4,8,10-12H,1-3,5-7,9,13H2
InChIKeyLWOJOEZHMQHFDG-UHFFFAOYSA-N
XLogP2.38
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.31
LogP ≤ 52.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 5-cyclohexyloxycyclohex-3-en-1-amine 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 5-cyclohexyloxycyclohex-3-en-1-amine?
The IUPAC name of 5-cyclohexyloxycyclohex-3-en-1-amine (CID 89073915) is 5-cyclohexyloxycyclohex-3-en-1-amine.
What is the SMILES notation for 5-cyclohexyloxycyclohex-3-en-1-amine?
The canonical SMILES for 5-cyclohexyloxycyclohex-3-en-1-amine is NC1CC=CC(OC2CCCCC2)C1.
What is the InChIKey of 5-cyclohexyloxycyclohex-3-en-1-amine?
The InChIKey is LWOJOEZHMQHFDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21NO/c13-10-5-4-8-12(9-10)14-11-6-2-1-3-7-11/h4,8,10-12H,1-3,5-7,9,13H2.
What are the key properties of 5-cyclohexyloxycyclohex-3-en-1-amine?
5-cyclohexyloxycyclohex-3-en-1-amine has a molecular weight of 195.31 g/mol, XLogP of 2.38, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclohexyloxycyclohex-3-en-1-amine is sourced from PubChem (CID 89073915), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).