N-[[2-(3-ethylcyclohexyl)cyclopentyl]methyl]cyclopropanamine

C17H31N — CID 81034069

IUPACN-[[2-(3-ethylcyclohexyl)cyclopentyl]methyl]cyclopropanamine
SMILESCCC1CCCC(C2CCCC2CNC2CC2)C1
InChIInChI=1S/C17H31N/c1-2-13-5-3-6-14(11-13)17-8-4-7-15(17)12-18-16-9-10-16/h13-18H,2-12H2,1H3
InChIKeyIRHIJYWGVIZAHN-UHFFFAOYSA-N
MW249.44 g/mol
LogP4.37
Rot. Bonds5

About N-[[2-(3-ethylcyclohexyl)cyclopentyl]methyl]cyclopropanamine

N-[[2-(3-ethylcyclohexyl)cyclopentyl]methyl]cyclopropanamine (PubChem CID 81034069) has the molecular formula C17H31N and a molecular weight of 249.44 g/mol. Its IUPAC name is N-[[2-(3-ethylcyclohexyl)cyclopentyl]methyl]cyclopropanamine.

Molecular Properties

Compound NameN-[[2-(3-ethylcyclohexyl)cyclopentyl]methyl]cyclopropanamine
PubChem CID81034069
Molecular FormulaC17H31N
Molecular Weight249.44 g/mol
Exact Mass249.25
IUPAC NameN-[[2-(3-ethylcyclohexyl)cyclopentyl]methyl]cyclopropanamine
SMILESCCC1CCCC(C2CCCC2CNC2CC2)C1
InChIInChI=1S/C17H31N/c1-2-13-5-3-6-14(11-13)17-8-4-7-15(17)12-18-16-9-10-16/h13-18H,2-12H2,1H3
InChIKeyIRHIJYWGVIZAHN-UHFFFAOYSA-N
XLogP4.37
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.44
LogP ≤ 54.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze N-[[2-(3-ethylcyclohexyl)cyclopentyl]methyl]cyclopropanamine 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

N-[[2-(3-methylcyclohexyl)cyclopentyl]methyl]cyclopropanamine
CID 81033733
N-[[4-ethyl-2-(3-methylcyclohexyl)cyclohexyl]methyl]cyclopropanamine
CID 81029060
N-[[2-(3-ethylcyclohexyl)cyclohexyl]methyl]propan-1-amine
CID 81026761
N-[(2-cycloheptylcycloheptyl)methyl]cyclopropanamine
CID 82935728
N-[[2-(3,5-dimethylcyclohexyl)cycloheptyl]methyl]cyclopropanamine
CID 81025418
1-[2-(3-ethylcyclohexyl)-4-methylcyclohexyl]-N-methylmethanamine
CID 81025745
cis-(1R,2S)-2-[[[(1S,3R)-3-ethylcyclohexyl]amino]methyl]cyclohexan-1-ol
CID 124834672
2-[[(3-ethylcyclohexyl)amino]methyl]cyclohexan-1-ol
CID 64926892
N-[(2-cyclohexylcyclobutyl)methyl]cyclopropanamine
CID 81017544
4-ethyl-2-(3-ethylcyclohexyl)cyclohexan-1-amine
CID 81014827
N-[[2-(3-ethylcyclohexyl)-4-methylcyclohexyl]methyl]propan-2-amine
CID 81032192
2-(3-ethylcyclohexyl)-4-methylcyclohexan-1-amine
CID 81014609

Frequently Asked Questions

What is the IUPAC name of N-[[2-(3-ethylcyclohexyl)cyclopentyl]methyl]cyclopropanamine?
The IUPAC name of N-[[2-(3-ethylcyclohexyl)cyclopentyl]methyl]cyclopropanamine (CID 81034069) is N-[[2-(3-ethylcyclohexyl)cyclopentyl]methyl]cyclopropanamine.
What is the SMILES notation for N-[[2-(3-ethylcyclohexyl)cyclopentyl]methyl]cyclopropanamine?
The canonical SMILES for N-[[2-(3-ethylcyclohexyl)cyclopentyl]methyl]cyclopropanamine is CCC1CCCC(C2CCCC2CNC2CC2)C1.
What is the InChIKey of N-[[2-(3-ethylcyclohexyl)cyclopentyl]methyl]cyclopropanamine?
The InChIKey is IRHIJYWGVIZAHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H31N/c1-2-13-5-3-6-14(11-13)17-8-4-7-15(17)12-18-16-9-10-16/h13-18H,2-12H2,1H3.
What are the key properties of N-[[2-(3-ethylcyclohexyl)cyclopentyl]methyl]cyclopropanamine?
N-[[2-(3-ethylcyclohexyl)cyclopentyl]methyl]cyclopropanamine has a molecular weight of 249.44 g/mol, XLogP of 4.37, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[2-(3-ethylcyclohexyl)cyclopentyl]methyl]cyclopropanamine is sourced from PubChem (CID 81034069), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).