4-cyclohexyl-2-cyclopentyl-N-ethylbutan-1-amine

C17H33N — CID 114192566

IUPAC4-cyclohexyl-2-cyclopentyl-N-ethylbutan-1-amine
SMILESCCNCC(CCC1CCCCC1)C1CCCC1
InChIInChI=1S/C17H33N/c1-2-18-14-17(16-10-6-7-11-16)13-12-15-8-4-3-5-9-15/h15-18H,2-14H2,1H3
InChIKeyFMCSIFGIGOJUSA-UHFFFAOYSA-N
MW251.46 g/mol
LogP4.76
Rot. Bonds7

About 4-cyclohexyl-2-cyclopentyl-N-ethylbutan-1-amine

4-cyclohexyl-2-cyclopentyl-N-ethylbutan-1-amine (PubChem CID 114192566) has the molecular formula C17H33N and a molecular weight of 251.46 g/mol. Its IUPAC name is 4-cyclohexyl-2-cyclopentyl-N-ethylbutan-1-amine.

Molecular Properties

Compound Name4-cyclohexyl-2-cyclopentyl-N-ethylbutan-1-amine
PubChem CID114192566
Molecular FormulaC17H33N
Molecular Weight251.46 g/mol
Exact Mass251.26
IUPAC Name4-cyclohexyl-2-cyclopentyl-N-ethylbutan-1-amine
SMILESCCNCC(CCC1CCCCC1)C1CCCC1
InChIInChI=1S/C17H33N/c1-2-18-14-17(16-10-6-7-11-16)13-12-15-8-4-3-5-9-15/h15-18H,2-14H2,1H3
InChIKeyFMCSIFGIGOJUSA-UHFFFAOYSA-N
XLogP4.76
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.46
LogP ≤ 54.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 4-cyclohexyl-2-cyclopentyl-N-ethylbutan-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 4-cyclohexyl-2-cyclopentyl-N-ethylbutan-1-amine?
The IUPAC name of 4-cyclohexyl-2-cyclopentyl-N-ethylbutan-1-amine (CID 114192566) is 4-cyclohexyl-2-cyclopentyl-N-ethylbutan-1-amine.
What is the SMILES notation for 4-cyclohexyl-2-cyclopentyl-N-ethylbutan-1-amine?
The canonical SMILES for 4-cyclohexyl-2-cyclopentyl-N-ethylbutan-1-amine is CCNCC(CCC1CCCCC1)C1CCCC1.
What is the InChIKey of 4-cyclohexyl-2-cyclopentyl-N-ethylbutan-1-amine?
The InChIKey is FMCSIFGIGOJUSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H33N/c1-2-18-14-17(16-10-6-7-11-16)13-12-15-8-4-3-5-9-15/h15-18H,2-14H2,1H3.
What are the key properties of 4-cyclohexyl-2-cyclopentyl-N-ethylbutan-1-amine?
4-cyclohexyl-2-cyclopentyl-N-ethylbutan-1-amine has a molecular weight of 251.46 g/mol, XLogP of 4.76, 7 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclohexyl-2-cyclopentyl-N-ethylbutan-1-amine is sourced from PubChem (CID 114192566), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).