4-benzyl-N-methylpiperidine-1-carboxamide

C14H20N2O — CID 10657233

IUPAC4-benzyl-N-methylpiperidine-1-carboxamide
SMILESCNC(=O)N1CCC(Cc2ccccc2)CC1
InChIInChI=1S/C14H20N2O/c1-15-14(17)16-9-7-13(8-10-16)11-12-5-3-2-4-6-12/h2-6,13H,7-11H2,1H3,(H,15,17)
InChIKeyZRKQOWGLWASDHM-UHFFFAOYSA-N
MW232.33 g/mol
LogP2.28
Rot. Bonds2

About 4-benzyl-N-methylpiperidine-1-carboxamide

4-benzyl-N-methylpiperidine-1-carboxamide (PubChem CID 10657233) has the molecular formula C14H20N2O and a molecular weight of 232.33 g/mol. Its IUPAC name is 4-benzyl-N-methylpiperidine-1-carboxamide.

Molecular Properties

Compound Name4-benzyl-N-methylpiperidine-1-carboxamide
PubChem CID10657233
Molecular FormulaC14H20N2O
Molecular Weight232.33 g/mol
Exact Mass232.16
IUPAC Name4-benzyl-N-methylpiperidine-1-carboxamide
SMILESCNC(=O)N1CCC(Cc2ccccc2)CC1
InChIInChI=1S/C14H20N2O/c1-15-14(17)16-9-7-13(8-10-16)11-12-5-3-2-4-6-12/h2-6,13H,7-11H2,1H3,(H,15,17)
InChIKeyZRKQOWGLWASDHM-UHFFFAOYSA-N
XLogP2.28
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.33
LogP ≤ 52.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 4-benzyl-N-methylpiperidine-1-carboxamide?
The IUPAC name of 4-benzyl-N-methylpiperidine-1-carboxamide (CID 10657233) is 4-benzyl-N-methylpiperidine-1-carboxamide.
What is the SMILES notation for 4-benzyl-N-methylpiperidine-1-carboxamide?
The canonical SMILES for 4-benzyl-N-methylpiperidine-1-carboxamide is CNC(=O)N1CCC(Cc2ccccc2)CC1.
What is the InChIKey of 4-benzyl-N-methylpiperidine-1-carboxamide?
The InChIKey is ZRKQOWGLWASDHM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O/c1-15-14(17)16-9-7-13(8-10-16)11-12-5-3-2-4-6-12/h2-6,13H,7-11H2,1H3,(H,15,17).
What are the key properties of 4-benzyl-N-methylpiperidine-1-carboxamide?
4-benzyl-N-methylpiperidine-1-carboxamide has a molecular weight of 232.33 g/mol, XLogP of 2.28, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-benzyl-N-methylpiperidine-1-carboxamide is sourced from PubChem (CID 10657233), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).