4-benzyl-N-propan-2-ylpiperidine-1-carboxamide

C16H24N2O — CID 10777770

IUPAC4-benzyl-N-propan-2-ylpiperidine-1-carboxamide
SMILESCC(C)NC(=O)N1CCC(Cc2ccccc2)CC1
InChIInChI=1S/C16H24N2O/c1-13(2)17-16(19)18-10-8-15(9-11-18)12-14-6-4-3-5-7-14/h3-7,13,15H,8-12H2,1-2H3,(H,17,19)
InChIKeyMUIWRALGGZLPEU-UHFFFAOYSA-N
MW260.38 g/mol
LogP3.06
Rot. Bonds3

About 4-benzyl-N-propan-2-ylpiperidine-1-carboxamide

4-benzyl-N-propan-2-ylpiperidine-1-carboxamide (PubChem CID 10777770) has the molecular formula C16H24N2O and a molecular weight of 260.38 g/mol. Its IUPAC name is 4-benzyl-N-propan-2-ylpiperidine-1-carboxamide.

Molecular Properties

Compound Name4-benzyl-N-propan-2-ylpiperidine-1-carboxamide
PubChem CID10777770
Molecular FormulaC16H24N2O
Molecular Weight260.38 g/mol
Exact Mass260.19
IUPAC Name4-benzyl-N-propan-2-ylpiperidine-1-carboxamide
SMILESCC(C)NC(=O)N1CCC(Cc2ccccc2)CC1
InChIInChI=1S/C16H24N2O/c1-13(2)17-16(19)18-10-8-15(9-11-18)12-14-6-4-3-5-7-14/h3-7,13,15H,8-12H2,1-2H3,(H,17,19)
InChIKeyMUIWRALGGZLPEU-UHFFFAOYSA-N
XLogP3.06
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.38
LogP ≤ 53.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 4-benzyl-N-propan-2-ylpiperidine-1-carboxamide?
The IUPAC name of 4-benzyl-N-propan-2-ylpiperidine-1-carboxamide (CID 10777770) is 4-benzyl-N-propan-2-ylpiperidine-1-carboxamide.
What is the SMILES notation for 4-benzyl-N-propan-2-ylpiperidine-1-carboxamide?
The canonical SMILES for 4-benzyl-N-propan-2-ylpiperidine-1-carboxamide is CC(C)NC(=O)N1CCC(Cc2ccccc2)CC1.
What is the InChIKey of 4-benzyl-N-propan-2-ylpiperidine-1-carboxamide?
The InChIKey is MUIWRALGGZLPEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O/c1-13(2)17-16(19)18-10-8-15(9-11-18)12-14-6-4-3-5-7-14/h3-7,13,15H,8-12H2,1-2H3,(H,17,19).
What are the key properties of 4-benzyl-N-propan-2-ylpiperidine-1-carboxamide?
4-benzyl-N-propan-2-ylpiperidine-1-carboxamide has a molecular weight of 260.38 g/mol, XLogP of 3.06, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-benzyl-N-propan-2-ylpiperidine-1-carboxamide is sourced from PubChem (CID 10777770), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).