N-(1-ethylpiperidin-4-yl)pyridine-2-carboxamide

C13H19N3O — CID 69401322

IUPACN-(1-ethylpiperidin-4-yl)pyridine-2-carboxamide
SMILESCCN1CCC(NC(=O)c2ccccn2)CC1
InChIInChI=1S/C13H19N3O/c1-2-16-9-6-11(7-10-16)15-13(17)12-5-3-4-8-14-12/h3-5,8,11H,2,6-7,9-10H2,1H3,(H,15,17)
InChIKeyVYAMIILXVLCCQD-UHFFFAOYSA-N
MW233.31 g/mol
LogP1.30
Rot. Bonds3

About N-(1-ethylpiperidin-4-yl)pyridine-2-carboxamide

N-(1-ethylpiperidin-4-yl)pyridine-2-carboxamide (PubChem CID 69401322) has the molecular formula C13H19N3O and a molecular weight of 233.31 g/mol. Its IUPAC name is N-(1-ethylpiperidin-4-yl)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-(1-ethylpiperidin-4-yl)pyridine-2-carboxamide
PubChem CID69401322
Molecular FormulaC13H19N3O
Molecular Weight233.31 g/mol
Exact Mass233.15
IUPAC NameN-(1-ethylpiperidin-4-yl)pyridine-2-carboxamide
SMILESCCN1CCC(NC(=O)c2ccccn2)CC1
InChIInChI=1S/C13H19N3O/c1-2-16-9-6-11(7-10-16)15-13(17)12-5-3-4-8-14-12/h3-5,8,11H,2,6-7,9-10H2,1H3,(H,15,17)
InChIKeyVYAMIILXVLCCQD-UHFFFAOYSA-N
XLogP1.30
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.31
LogP ≤ 51.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(1-ethylpiperidin-4-yl)pyridine-2-carboxamide?
The IUPAC name of N-(1-ethylpiperidin-4-yl)pyridine-2-carboxamide (CID 69401322) is N-(1-ethylpiperidin-4-yl)pyridine-2-carboxamide.
What is the SMILES notation for N-(1-ethylpiperidin-4-yl)pyridine-2-carboxamide?
The canonical SMILES for N-(1-ethylpiperidin-4-yl)pyridine-2-carboxamide is CCN1CCC(NC(=O)c2ccccn2)CC1.
What is the InChIKey of N-(1-ethylpiperidin-4-yl)pyridine-2-carboxamide?
The InChIKey is VYAMIILXVLCCQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3O/c1-2-16-9-6-11(7-10-16)15-13(17)12-5-3-4-8-14-12/h3-5,8,11H,2,6-7,9-10H2,1H3,(H,15,17).
What are the key properties of N-(1-ethylpiperidin-4-yl)pyridine-2-carboxamide?
N-(1-ethylpiperidin-4-yl)pyridine-2-carboxamide has a molecular weight of 233.31 g/mol, XLogP of 1.30, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-ethylpiperidin-4-yl)pyridine-2-carboxamide is sourced from PubChem (CID 69401322), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).