N-(1-pyridin-2-ylethyl)piperidine-1-carboxamide

C13H19N3O — CID 113221669

IUPACN-(1-pyridin-2-ylethyl)piperidine-1-carboxamide
SMILESCC(NC(=O)N1CCCCC1)c1ccccn1
InChIInChI=1S/C13H19N3O/c1-11(12-7-3-4-8-14-12)15-13(17)16-9-5-2-6-10-16/h3-4,7-8,11H,2,5-6,9-10H2,1H3,(H,15,17)
InChIKeyRFCNPFZGQFWJLP-UHFFFAOYSA-N
MW233.32 g/mol
LogP2.34
Rot. Bonds2

About N-(1-pyridin-2-ylethyl)piperidine-1-carboxamide

N-(1-pyridin-2-ylethyl)piperidine-1-carboxamide (PubChem CID 113221669) has the molecular formula C13H19N3O and a molecular weight of 233.32 g/mol. Its IUPAC name is N-(1-pyridin-2-ylethyl)piperidine-1-carboxamide.

Molecular Properties

Compound NameN-(1-pyridin-2-ylethyl)piperidine-1-carboxamide
PubChem CID113221669
Molecular FormulaC13H19N3O
Molecular Weight233.32 g/mol
Exact Mass233.15
IUPAC NameN-(1-pyridin-2-ylethyl)piperidine-1-carboxamide
SMILESCC(NC(=O)N1CCCCC1)c1ccccn1
InChIInChI=1S/C13H19N3O/c1-11(12-7-3-4-8-14-12)15-13(17)16-9-5-2-6-10-16/h3-4,7-8,11H,2,5-6,9-10H2,1H3,(H,15,17)
InChIKeyRFCNPFZGQFWJLP-UHFFFAOYSA-N
XLogP2.34
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.32
LogP ≤ 52.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(1-pyridin-2-ylethyl)piperidine-1-carboxamide?
The IUPAC name of N-(1-pyridin-2-ylethyl)piperidine-1-carboxamide (CID 113221669) is N-(1-pyridin-2-ylethyl)piperidine-1-carboxamide.
What is the SMILES notation for N-(1-pyridin-2-ylethyl)piperidine-1-carboxamide?
The canonical SMILES for N-(1-pyridin-2-ylethyl)piperidine-1-carboxamide is CC(NC(=O)N1CCCCC1)c1ccccn1.
What is the InChIKey of N-(1-pyridin-2-ylethyl)piperidine-1-carboxamide?
The InChIKey is RFCNPFZGQFWJLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3O/c1-11(12-7-3-4-8-14-12)15-13(17)16-9-5-2-6-10-16/h3-4,7-8,11H,2,5-6,9-10H2,1H3,(H,15,17).
What are the key properties of N-(1-pyridin-2-ylethyl)piperidine-1-carboxamide?
N-(1-pyridin-2-ylethyl)piperidine-1-carboxamide has a molecular weight of 233.32 g/mol, XLogP of 2.34, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-pyridin-2-ylethyl)piperidine-1-carboxamide is sourced from PubChem (CID 113221669), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).