N-benzyl-N-methyl-1-piperidin-4-ylmethanamine

C14H22N2 — CID 16767918

IUPACN-benzyl-N-methyl-1-piperidin-4-ylmethanamine
SMILESCN(Cc1ccccc1)CC1CCNCC1
InChIInChI=1S/C14H22N2/c1-16(11-13-5-3-2-4-6-13)12-14-7-9-15-10-8-14/h2-6,14-15H,7-12H2,1H3
InChIKeyRKONUTWCBKFEFZ-UHFFFAOYSA-N
MW218.34 g/mol
LogP2.12
Rot. Bonds4

About N-benzyl-N-methyl-1-piperidin-4-ylmethanamine

N-benzyl-N-methyl-1-piperidin-4-ylmethanamine (PubChem CID 16767918) has the molecular formula C14H22N2 and a molecular weight of 218.34 g/mol. Its IUPAC name is N-benzyl-N-methyl-1-piperidin-4-ylmethanamine.

Molecular Properties

Compound NameN-benzyl-N-methyl-1-piperidin-4-ylmethanamine
PubChem CID16767918
Molecular FormulaC14H22N2
Molecular Weight218.34 g/mol
Exact Mass218.18
IUPAC NameN-benzyl-N-methyl-1-piperidin-4-ylmethanamine
SMILESCN(Cc1ccccc1)CC1CCNCC1
InChIInChI=1S/C14H22N2/c1-16(11-13-5-3-2-4-6-13)12-14-7-9-15-10-8-14/h2-6,14-15H,7-12H2,1H3
InChIKeyRKONUTWCBKFEFZ-UHFFFAOYSA-N
XLogP2.12
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.34
LogP ≤ 52.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-benzyl-N-methyl-1-piperidin-4-ylmethanamine?
The IUPAC name of N-benzyl-N-methyl-1-piperidin-4-ylmethanamine (CID 16767918) is N-benzyl-N-methyl-1-piperidin-4-ylmethanamine.
What is the SMILES notation for N-benzyl-N-methyl-1-piperidin-4-ylmethanamine?
The canonical SMILES for N-benzyl-N-methyl-1-piperidin-4-ylmethanamine is CN(Cc1ccccc1)CC1CCNCC1.
What is the InChIKey of N-benzyl-N-methyl-1-piperidin-4-ylmethanamine?
The InChIKey is RKONUTWCBKFEFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2/c1-16(11-13-5-3-2-4-6-13)12-14-7-9-15-10-8-14/h2-6,14-15H,7-12H2,1H3.
What are the key properties of N-benzyl-N-methyl-1-piperidin-4-ylmethanamine?
N-benzyl-N-methyl-1-piperidin-4-ylmethanamine has a molecular weight of 218.34 g/mol, XLogP of 2.12, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-N-methyl-1-piperidin-4-ylmethanamine is sourced from PubChem (CID 16767918), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).