[1-(2-ethylpiperidin-1-yl)-3-methylcyclohexyl]methanamine

C15H30N2 — CID 43213400

IUPAC[1-(2-ethylpiperidin-1-yl)-3-methylcyclohexyl]methanamine
SMILESCCC1CCCCN1C1(CN)CCCC(C)C1
InChIInChI=1S/C15H30N2/c1-3-14-8-4-5-10-17(14)15(12-16)9-6-7-13(2)11-15/h13-14H,3-12,16H2,1-2H3
InChIKeyQYUTYCRZNSTAFT-UHFFFAOYSA-N
MW238.42 g/mol
LogP3.16
Rot. Bonds3

About [1-(2-ethylpiperidin-1-yl)-3-methylcyclohexyl]methanamine

[1-(2-ethylpiperidin-1-yl)-3-methylcyclohexyl]methanamine (PubChem CID 43213400) has the molecular formula C15H30N2 and a molecular weight of 238.42 g/mol. Its IUPAC name is [1-(2-ethylpiperidin-1-yl)-3-methylcyclohexyl]methanamine.

Molecular Properties

Compound Name[1-(2-ethylpiperidin-1-yl)-3-methylcyclohexyl]methanamine
PubChem CID43213400
Molecular FormulaC15H30N2
Molecular Weight238.42 g/mol
Exact Mass238.24
IUPAC Name[1-(2-ethylpiperidin-1-yl)-3-methylcyclohexyl]methanamine
SMILESCCC1CCCCN1C1(CN)CCCC(C)C1
InChIInChI=1S/C15H30N2/c1-3-14-8-4-5-10-17(14)15(12-16)9-6-7-13(2)11-15/h13-14H,3-12,16H2,1-2H3
InChIKeyQYUTYCRZNSTAFT-UHFFFAOYSA-N
XLogP3.16
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.42
LogP ≤ 53.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze [1-(2-ethylpiperidin-1-yl)-3-methylcyclohexyl]methanamine 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 [1-(2-ethylpiperidin-1-yl)-3-methylcyclohexyl]methanamine?
The IUPAC name of [1-(2-ethylpiperidin-1-yl)-3-methylcyclohexyl]methanamine (CID 43213400) is [1-(2-ethylpiperidin-1-yl)-3-methylcyclohexyl]methanamine.
What is the SMILES notation for [1-(2-ethylpiperidin-1-yl)-3-methylcyclohexyl]methanamine?
The canonical SMILES for [1-(2-ethylpiperidin-1-yl)-3-methylcyclohexyl]methanamine is CCC1CCCCN1C1(CN)CCCC(C)C1.
What is the InChIKey of [1-(2-ethylpiperidin-1-yl)-3-methylcyclohexyl]methanamine?
The InChIKey is QYUTYCRZNSTAFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2/c1-3-14-8-4-5-10-17(14)15(12-16)9-6-7-13(2)11-15/h13-14H,3-12,16H2,1-2H3.
What are the key properties of [1-(2-ethylpiperidin-1-yl)-3-methylcyclohexyl]methanamine?
[1-(2-ethylpiperidin-1-yl)-3-methylcyclohexyl]methanamine has a molecular weight of 238.42 g/mol, XLogP of 3.16, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2-ethylpiperidin-1-yl)-3-methylcyclohexyl]methanamine is sourced from PubChem (CID 43213400), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).