N-benzyl-N-methylpiperidin-4-amine;hydrochloride

C13H21ClN2 — CID 24746773

IUPACN-benzyl-N-methylpiperidin-4-amine;hydrochloride
SMILESCN(Cc1ccccc1)C1CCNCC1.Cl
InChIInChI=1S/C13H20N2.ClH/c1-15(13-7-9-14-10-8-13)11-12-5-3-2-4-6-12;/h2-6,13-14H,7-11H2,1H3;1H
InChIKeyOEYPIIOXYXYLQG-UHFFFAOYSA-N
MW240.78 g/mol
LogP2.29
Rot. Bonds3

About N-benzyl-N-methylpiperidin-4-amine;hydrochloride

N-benzyl-N-methylpiperidin-4-amine;hydrochloride (PubChem CID 24746773) has the molecular formula C13H21ClN2 and a molecular weight of 240.78 g/mol. Its IUPAC name is N-benzyl-N-methylpiperidin-4-amine;hydrochloride.

Molecular Properties

Compound NameN-benzyl-N-methylpiperidin-4-amine;hydrochloride
PubChem CID24746773
Molecular FormulaC13H21ClN2
Molecular Weight240.78 g/mol
Exact Mass240.14
IUPAC NameN-benzyl-N-methylpiperidin-4-amine;hydrochloride
SMILESCN(Cc1ccccc1)C1CCNCC1.Cl
InChIInChI=1S/C13H20N2.ClH/c1-15(13-7-9-14-10-8-13)11-12-5-3-2-4-6-12;/h2-6,13-14H,7-11H2,1H3;1H
InChIKeyOEYPIIOXYXYLQG-UHFFFAOYSA-N
XLogP2.29
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.78
LogP ≤ 52.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-benzyl-N-methylpiperidin-4-amine;hydrochloride 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-benzyl-N-methylpiperidin-4-amine;hydrochloride?
The IUPAC name of N-benzyl-N-methylpiperidin-4-amine;hydrochloride (CID 24746773) is N-benzyl-N-methylpiperidin-4-amine;hydrochloride.
What is the SMILES notation for N-benzyl-N-methylpiperidin-4-amine;hydrochloride?
The canonical SMILES for N-benzyl-N-methylpiperidin-4-amine;hydrochloride is CN(Cc1ccccc1)C1CCNCC1.Cl.
What is the InChIKey of N-benzyl-N-methylpiperidin-4-amine;hydrochloride?
The InChIKey is OEYPIIOXYXYLQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2.ClH/c1-15(13-7-9-14-10-8-13)11-12-5-3-2-4-6-12;/h2-6,13-14H,7-11H2,1H3;1H.
What are the key properties of N-benzyl-N-methylpiperidin-4-amine;hydrochloride?
N-benzyl-N-methylpiperidin-4-amine;hydrochloride has a molecular weight of 240.78 g/mol, XLogP of 2.29, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-N-methylpiperidin-4-amine;hydrochloride is sourced from PubChem (CID 24746773), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).