N-[(4-methylcyclohexyl)methyl]piperidin-3-amine

C13H26N2 — CID 63243171

IUPACN-[(4-methylcyclohexyl)methyl]piperidin-3-amine
SMILESCC1CCC(CNC2CCCNC2)CC1
InChIInChI=1S/C13H26N2/c1-11-4-6-12(7-5-11)9-15-13-3-2-8-14-10-13/h11-15H,2-10H2,1H3
InChIKeyZXVDLJWNVZEGRN-UHFFFAOYSA-N
MW210.36 g/mol
LogP2.15
Rot. Bonds3

About N-[(4-methylcyclohexyl)methyl]piperidin-3-amine

N-[(4-methylcyclohexyl)methyl]piperidin-3-amine (PubChem CID 63243171) has the molecular formula C13H26N2 and a molecular weight of 210.36 g/mol. Its IUPAC name is N-[(4-methylcyclohexyl)methyl]piperidin-3-amine.

Molecular Properties

Compound NameN-[(4-methylcyclohexyl)methyl]piperidin-3-amine
PubChem CID63243171
Molecular FormulaC13H26N2
Molecular Weight210.36 g/mol
Exact Mass210.21
IUPAC NameN-[(4-methylcyclohexyl)methyl]piperidin-3-amine
SMILESCC1CCC(CNC2CCCNC2)CC1
InChIInChI=1S/C13H26N2/c1-11-4-6-12(7-5-11)9-15-13-3-2-8-14-10-13/h11-15H,2-10H2,1H3
InChIKeyZXVDLJWNVZEGRN-UHFFFAOYSA-N
XLogP2.15
TPSA24.06 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 ≤ 52.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze N-[(4-methylcyclohexyl)methyl]piperidin-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-[(4-methylcyclohexyl)methyl]piperidin-3-amine?
The IUPAC name of N-[(4-methylcyclohexyl)methyl]piperidin-3-amine (CID 63243171) is N-[(4-methylcyclohexyl)methyl]piperidin-3-amine.
What is the SMILES notation for N-[(4-methylcyclohexyl)methyl]piperidin-3-amine?
The canonical SMILES for N-[(4-methylcyclohexyl)methyl]piperidin-3-amine is CC1CCC(CNC2CCCNC2)CC1.
What is the InChIKey of N-[(4-methylcyclohexyl)methyl]piperidin-3-amine?
The InChIKey is ZXVDLJWNVZEGRN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2/c1-11-4-6-12(7-5-11)9-15-13-3-2-8-14-10-13/h11-15H,2-10H2,1H3.
What are the key properties of N-[(4-methylcyclohexyl)methyl]piperidin-3-amine?
N-[(4-methylcyclohexyl)methyl]piperidin-3-amine has a molecular weight of 210.36 g/mol, XLogP of 2.15, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-methylcyclohexyl)methyl]piperidin-3-amine is sourced from PubChem (CID 63243171), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).