N'-cyclopentyl-N'-methyl-N-(3-methylcyclohexyl)ethane-1,2-diamine

C15H30N2 — CID 62576013

IUPACN'-cyclopentyl-N'-methyl-N-(3-methylcyclohexyl)ethane-1,2-diamine
SMILESCC1CCCC(NCCN(C)C2CCCC2)C1
InChIInChI=1S/C15H30N2/c1-13-6-5-7-14(12-13)16-10-11-17(2)15-8-3-4-9-15/h13-16H,3-12H2,1-2H3
InChIKeyNIIAEUAVZHIZGZ-UHFFFAOYSA-N
MW238.42 g/mol
LogP3.03
Rot. Bonds5

About N'-cyclopentyl-N'-methyl-N-(3-methylcyclohexyl)ethane-1,2-diamine

N'-cyclopentyl-N'-methyl-N-(3-methylcyclohexyl)ethane-1,2-diamine (PubChem CID 62576013) has the molecular formula C15H30N2 and a molecular weight of 238.42 g/mol. Its IUPAC name is N'-cyclopentyl-N'-methyl-N-(3-methylcyclohexyl)ethane-1,2-diamine.

Molecular Properties

Compound NameN'-cyclopentyl-N'-methyl-N-(3-methylcyclohexyl)ethane-1,2-diamine
PubChem CID62576013
Molecular FormulaC15H30N2
Molecular Weight238.42 g/mol
Exact Mass238.24
IUPAC NameN'-cyclopentyl-N'-methyl-N-(3-methylcyclohexyl)ethane-1,2-diamine
SMILESCC1CCCC(NCCN(C)C2CCCC2)C1
InChIInChI=1S/C15H30N2/c1-13-6-5-7-14(12-13)16-10-11-17(2)15-8-3-4-9-15/h13-16H,3-12H2,1-2H3
InChIKeyNIIAEUAVZHIZGZ-UHFFFAOYSA-N
XLogP3.03
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.42
LogP ≤ 53.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N'-cyclopentyl-N'-methyl-N-(3-methylcyclohexyl)ethane-1,2-diamine 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,N'-dicyclopentyl-N'-methylethane-1,2-diamine
CID 60850716
N-cyclopropyl-N'-methyl-N'-(3-methylcyclohexyl)ethane-1,2-diamine
CID 61447072
N'-methyl-N-(3-methylcyclohexyl)-N'-(thiolan-3-yl)ethane-1,2-diamine
CID 62561683
N,N,N'-trimethyl-N'-[2-[(3-methylcyclohexyl)amino]ethyl]propane-1,3-diamine
CID 63726355
cis-(1R,3S)-3-methyl-N-propylcyclohexan-1-amine
CID 15350394
N'-(4-fluorophenyl)-N'-methyl-N-(3-methylcyclohexyl)ethane-1,2-diamine
CID 62554580
N'-cyclohexyl-N'-methyl-N-(oxan-4-yl)ethane-1,2-diamine
CID 63098109
N'-cyclopropyl-N-(3-methylcyclohexyl)-N'-(2,2,2-trifluoroethyl)ethane-1,2-diamine
CID 62554163
N'-cyclopentyl-N-(1-cyclopropyl-5-methylpyrrolidin-3-yl)-N'-methylethane-1,2-diamine
CID 115717762
N'-cyclopropyl-N'-(2-methoxyethyl)-N-(3-methylcyclohexyl)ethane-1,2-diamine
CID 62553966
N'-[(4-bromophenyl)methyl]-N'-methyl-N-(3-methylcyclohexyl)ethane-1,2-diamine
CID 63502762
N'-methyl-N-(3-methylcyclohexyl)-N'-(pyridin-4-ylmethyl)ethane-1,2-diamine
CID 62560432

Frequently Asked Questions

What is the IUPAC name of N'-cyclopentyl-N'-methyl-N-(3-methylcyclohexyl)ethane-1,2-diamine?
The IUPAC name of N'-cyclopentyl-N'-methyl-N-(3-methylcyclohexyl)ethane-1,2-diamine (CID 62576013) is N'-cyclopentyl-N'-methyl-N-(3-methylcyclohexyl)ethane-1,2-diamine.
What is the SMILES notation for N'-cyclopentyl-N'-methyl-N-(3-methylcyclohexyl)ethane-1,2-diamine?
The canonical SMILES for N'-cyclopentyl-N'-methyl-N-(3-methylcyclohexyl)ethane-1,2-diamine is CC1CCCC(NCCN(C)C2CCCC2)C1.
What is the InChIKey of N'-cyclopentyl-N'-methyl-N-(3-methylcyclohexyl)ethane-1,2-diamine?
The InChIKey is NIIAEUAVZHIZGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2/c1-13-6-5-7-14(12-13)16-10-11-17(2)15-8-3-4-9-15/h13-16H,3-12H2,1-2H3.
What are the key properties of N'-cyclopentyl-N'-methyl-N-(3-methylcyclohexyl)ethane-1,2-diamine?
N'-cyclopentyl-N'-methyl-N-(3-methylcyclohexyl)ethane-1,2-diamine has a molecular weight of 238.42 g/mol, XLogP of 3.03, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-cyclopentyl-N'-methyl-N-(3-methylcyclohexyl)ethane-1,2-diamine is sourced from PubChem (CID 62576013), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).