3-N-(3-ethyl-2-methylcyclopentyl)cyclopentane-1,3-diamine

C13H26N2 — CID 79462176

IUPAC3-N-(3-ethyl-2-methylcyclopentyl)cyclopentane-1,3-diamine
SMILESCCC1CCC(NC2CCC(N)C2)C1C
InChIInChI=1S/C13H26N2/c1-3-10-4-7-13(9(10)2)15-12-6-5-11(14)8-12/h9-13,15H,3-8,14H2,1-2H3
InChIKeyJAZSXXZMYCDCBA-UHFFFAOYSA-N
MW210.36 g/mol
LogP2.28
Rot. Bonds3

About 3-N-(3-ethyl-2-methylcyclopentyl)cyclopentane-1,3-diamine

3-N-(3-ethyl-2-methylcyclopentyl)cyclopentane-1,3-diamine (PubChem CID 79462176) has the molecular formula C13H26N2 and a molecular weight of 210.36 g/mol. Its IUPAC name is 3-N-(3-ethyl-2-methylcyclopentyl)cyclopentane-1,3-diamine.

Molecular Properties

Compound Name3-N-(3-ethyl-2-methylcyclopentyl)cyclopentane-1,3-diamine
PubChem CID79462176
Molecular FormulaC13H26N2
Molecular Weight210.36 g/mol
Exact Mass210.21
IUPAC Name3-N-(3-ethyl-2-methylcyclopentyl)cyclopentane-1,3-diamine
SMILESCCC1CCC(NC2CCC(N)C2)C1C
InChIInChI=1S/C13H26N2/c1-3-10-4-7-13(9(10)2)15-12-6-5-11(14)8-12/h9-13,15H,3-8,14H2,1-2H3
InChIKeyJAZSXXZMYCDCBA-UHFFFAOYSA-N
XLogP2.28
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.36
LogP ≤ 52.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 3-N-(3-ethyl-2-methylcyclopentyl)cyclopentane-1,3-diamine 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 3-N-(3-ethyl-2-methylcyclopentyl)cyclopentane-1,3-diamine?
The IUPAC name of 3-N-(3-ethyl-2-methylcyclopentyl)cyclopentane-1,3-diamine (CID 79462176) is 3-N-(3-ethyl-2-methylcyclopentyl)cyclopentane-1,3-diamine.
What is the SMILES notation for 3-N-(3-ethyl-2-methylcyclopentyl)cyclopentane-1,3-diamine?
The canonical SMILES for 3-N-(3-ethyl-2-methylcyclopentyl)cyclopentane-1,3-diamine is CCC1CCC(NC2CCC(N)C2)C1C.
What is the InChIKey of 3-N-(3-ethyl-2-methylcyclopentyl)cyclopentane-1,3-diamine?
The InChIKey is JAZSXXZMYCDCBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2/c1-3-10-4-7-13(9(10)2)15-12-6-5-11(14)8-12/h9-13,15H,3-8,14H2,1-2H3.
What are the key properties of 3-N-(3-ethyl-2-methylcyclopentyl)cyclopentane-1,3-diamine?
3-N-(3-ethyl-2-methylcyclopentyl)cyclopentane-1,3-diamine has a molecular weight of 210.36 g/mol, XLogP of 2.28, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-N-(3-ethyl-2-methylcyclopentyl)cyclopentane-1,3-diamine is sourced from PubChem (CID 79462176), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).