N-benzyl-2-methylpiperidin-3-amine

C13H20N2 — CID 131060344

IUPACN-benzyl-2-methylpiperidin-3-amine
SMILESCC1NCCCC1NCc1ccccc1
InChIInChI=1S/C13H20N2/c1-11-13(8-5-9-14-11)15-10-12-6-3-2-4-7-12/h2-4,6-7,11,13-15H,5,8-10H2,1H3
InChIKeyVNUWTECMLYRBOE-UHFFFAOYSA-N
MW204.32 g/mol
LogP1.92
Rot. Bonds3

About N-benzyl-2-methylpiperidin-3-amine

N-benzyl-2-methylpiperidin-3-amine (PubChem CID 131060344) has the molecular formula C13H20N2 and a molecular weight of 204.32 g/mol. Its IUPAC name is N-benzyl-2-methylpiperidin-3-amine.

Molecular Properties

Compound NameN-benzyl-2-methylpiperidin-3-amine
PubChem CID131060344
Molecular FormulaC13H20N2
Molecular Weight204.32 g/mol
Exact Mass204.16
IUPAC NameN-benzyl-2-methylpiperidin-3-amine
SMILESCC1NCCCC1NCc1ccccc1
InChIInChI=1S/C13H20N2/c1-11-13(8-5-9-14-11)15-10-12-6-3-2-4-7-12/h2-4,6-7,11,13-15H,5,8-10H2,1H3
InChIKeyVNUWTECMLYRBOE-UHFFFAOYSA-N
XLogP1.92
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.32
LogP ≤ 51.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-benzyl-2-methylpiperidin-3-amine?
The IUPAC name of N-benzyl-2-methylpiperidin-3-amine (CID 131060344) is N-benzyl-2-methylpiperidin-3-amine.
What is the SMILES notation for N-benzyl-2-methylpiperidin-3-amine?
The canonical SMILES for N-benzyl-2-methylpiperidin-3-amine is CC1NCCCC1NCc1ccccc1.
What is the InChIKey of N-benzyl-2-methylpiperidin-3-amine?
The InChIKey is VNUWTECMLYRBOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2/c1-11-13(8-5-9-14-11)15-10-12-6-3-2-4-7-12/h2-4,6-7,11,13-15H,5,8-10H2,1H3.
What are the key properties of N-benzyl-2-methylpiperidin-3-amine?
N-benzyl-2-methylpiperidin-3-amine has a molecular weight of 204.32 g/mol, XLogP of 1.92, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-2-methylpiperidin-3-amine is sourced from PubChem (CID 131060344), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).