N-[1-(aminomethyl)-2-ethylcyclopentyl]-N-methyloxan-4-amine

C14H28N2O — CID 113483713

IUPACN-[1-(aminomethyl)-2-ethylcyclopentyl]-N-methyloxan-4-amine
SMILESCCC1CCCC1(CN)N(C)C1CCOCC1
InChIInChI=1S/C14H28N2O/c1-3-12-5-4-8-14(12,11-15)16(2)13-6-9-17-10-7-13/h12-13H,3-11,15H2,1-2H3
InChIKeyMBIJWEDZHMIBLL-UHFFFAOYSA-N
MW240.39 g/mol
LogP2.00
Rot. Bonds4

About N-[1-(aminomethyl)-2-ethylcyclopentyl]-N-methyloxan-4-amine

N-[1-(aminomethyl)-2-ethylcyclopentyl]-N-methyloxan-4-amine (PubChem CID 113483713) has the molecular formula C14H28N2O and a molecular weight of 240.39 g/mol. Its IUPAC name is N-[1-(aminomethyl)-2-ethylcyclopentyl]-N-methyloxan-4-amine.

Molecular Properties

Compound NameN-[1-(aminomethyl)-2-ethylcyclopentyl]-N-methyloxan-4-amine
PubChem CID113483713
Molecular FormulaC14H28N2O
Molecular Weight240.39 g/mol
Exact Mass240.22
IUPAC NameN-[1-(aminomethyl)-2-ethylcyclopentyl]-N-methyloxan-4-amine
SMILESCCC1CCCC1(CN)N(C)C1CCOCC1
InChIInChI=1S/C14H28N2O/c1-3-12-5-4-8-14(12,11-15)16(2)13-6-9-17-10-7-13/h12-13H,3-11,15H2,1-2H3
InChIKeyMBIJWEDZHMIBLL-UHFFFAOYSA-N
XLogP2.00
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.39
LogP ≤ 52.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[1-(aminomethyl)-2-ethylcyclopentyl]-N-methyloxan-4-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 N-[1-(aminomethyl)-2-ethylcyclopentyl]-N-methyloxan-4-amine?
The IUPAC name of N-[1-(aminomethyl)-2-ethylcyclopentyl]-N-methyloxan-4-amine (CID 113483713) is N-[1-(aminomethyl)-2-ethylcyclopentyl]-N-methyloxan-4-amine.
What is the SMILES notation for N-[1-(aminomethyl)-2-ethylcyclopentyl]-N-methyloxan-4-amine?
The canonical SMILES for N-[1-(aminomethyl)-2-ethylcyclopentyl]-N-methyloxan-4-amine is CCC1CCCC1(CN)N(C)C1CCOCC1.
What is the InChIKey of N-[1-(aminomethyl)-2-ethylcyclopentyl]-N-methyloxan-4-amine?
The InChIKey is MBIJWEDZHMIBLL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O/c1-3-12-5-4-8-14(12,11-15)16(2)13-6-9-17-10-7-13/h12-13H,3-11,15H2,1-2H3.
What are the key properties of N-[1-(aminomethyl)-2-ethylcyclopentyl]-N-methyloxan-4-amine?
N-[1-(aminomethyl)-2-ethylcyclopentyl]-N-methyloxan-4-amine has a molecular weight of 240.39 g/mol, XLogP of 2.00, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(aminomethyl)-2-ethylcyclopentyl]-N-methyloxan-4-amine is sourced from PubChem (CID 113483713), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).