N-(2-cyclohexylethyl)-2,3-dimethyloxolan-3-amine

C14H27NO — CID 103529185

IUPACN-(2-cyclohexylethyl)-2,3-dimethyloxolan-3-amine
SMILESCC1OCCC1(C)NCCC1CCCCC1
InChIInChI=1S/C14H27NO/c1-12-14(2,9-11-16-12)15-10-8-13-6-4-3-5-7-13/h12-13,15H,3-11H2,1-2H3
InChIKeyXVLDSTVCDRBITI-UHFFFAOYSA-N
MW225.38 g/mol
LogP3.11
Rot. Bonds4

About N-(2-cyclohexylethyl)-2,3-dimethyloxolan-3-amine

N-(2-cyclohexylethyl)-2,3-dimethyloxolan-3-amine (PubChem CID 103529185) has the molecular formula C14H27NO and a molecular weight of 225.38 g/mol. Its IUPAC name is N-(2-cyclohexylethyl)-2,3-dimethyloxolan-3-amine.

Molecular Properties

Compound NameN-(2-cyclohexylethyl)-2,3-dimethyloxolan-3-amine
PubChem CID103529185
Molecular FormulaC14H27NO
Molecular Weight225.38 g/mol
Exact Mass225.21
IUPAC NameN-(2-cyclohexylethyl)-2,3-dimethyloxolan-3-amine
SMILESCC1OCCC1(C)NCCC1CCCCC1
InChIInChI=1S/C14H27NO/c1-12-14(2,9-11-16-12)15-10-8-13-6-4-3-5-7-13/h12-13,15H,3-11H2,1-2H3
InChIKeyXVLDSTVCDRBITI-UHFFFAOYSA-N
XLogP3.11
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.38
LogP ≤ 53.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-(2-cyclohexylethyl)-2,3-dimethyloxolan-3-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-(2-cyclohexylethyl)-2,3-dimethyloxolan-3-amine?
The IUPAC name of N-(2-cyclohexylethyl)-2,3-dimethyloxolan-3-amine (CID 103529185) is N-(2-cyclohexylethyl)-2,3-dimethyloxolan-3-amine.
What is the SMILES notation for N-(2-cyclohexylethyl)-2,3-dimethyloxolan-3-amine?
The canonical SMILES for N-(2-cyclohexylethyl)-2,3-dimethyloxolan-3-amine is CC1OCCC1(C)NCCC1CCCCC1.
What is the InChIKey of N-(2-cyclohexylethyl)-2,3-dimethyloxolan-3-amine?
The InChIKey is XVLDSTVCDRBITI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27NO/c1-12-14(2,9-11-16-12)15-10-8-13-6-4-3-5-7-13/h12-13,15H,3-11H2,1-2H3.
What are the key properties of N-(2-cyclohexylethyl)-2,3-dimethyloxolan-3-amine?
N-(2-cyclohexylethyl)-2,3-dimethyloxolan-3-amine has a molecular weight of 225.38 g/mol, XLogP of 3.11, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyclohexylethyl)-2,3-dimethyloxolan-3-amine is sourced from PubChem (CID 103529185), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).