N-(1-piperidin-3-ylethyl)pyridine-4-carboxamide

C13H19N3O — CID 62032705

IUPACN-(1-piperidin-3-ylethyl)pyridine-4-carboxamide
SMILESCC(NC(=O)c1ccncc1)C1CCCNC1
InChIInChI=1S/C13H19N3O/c1-10(12-3-2-6-15-9-12)16-13(17)11-4-7-14-8-5-11/h4-5,7-8,10,12,15H,2-3,6,9H2,1H3,(H,16,17)
InChIKeyOOKAUYMZWJLLRR-UHFFFAOYSA-N
MW233.31 g/mol
LogP1.20
Rot. Bonds3

About N-(1-piperidin-3-ylethyl)pyridine-4-carboxamide

N-(1-piperidin-3-ylethyl)pyridine-4-carboxamide (PubChem CID 62032705) has the molecular formula C13H19N3O and a molecular weight of 233.31 g/mol. Its IUPAC name is N-(1-piperidin-3-ylethyl)pyridine-4-carboxamide.

Molecular Properties

Compound NameN-(1-piperidin-3-ylethyl)pyridine-4-carboxamide
PubChem CID62032705
Molecular FormulaC13H19N3O
Molecular Weight233.31 g/mol
Exact Mass233.15
IUPAC NameN-(1-piperidin-3-ylethyl)pyridine-4-carboxamide
SMILESCC(NC(=O)c1ccncc1)C1CCCNC1
InChIInChI=1S/C13H19N3O/c1-10(12-3-2-6-15-9-12)16-13(17)11-4-7-14-8-5-11/h4-5,7-8,10,12,15H,2-3,6,9H2,1H3,(H,16,17)
InChIKeyOOKAUYMZWJLLRR-UHFFFAOYSA-N
XLogP1.20
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.31
LogP ≤ 51.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(1-piperidin-3-ylethyl)pyridazine-4-carboxamide
CID 104671340
N-(1-piperidin-3-ylethyl)-4-(trifluoromethyl)benzamide;hydrochloride
CID 119473934
3-methyl-N-(1-piperidin-3-ylethyl)benzamide
CID 43523133
N-(1-pyrrolidin-3-ylethyl)benzamide
CID 103977078
1-methyl-2-oxo-N-(1-piperidin-3-ylethyl)pyridine-4-carboxamide
CID 103793645
3-fluoro-N-(1-piperidin-3-ylethyl)benzamide
CID 43523136
2-chloro-N-(1-piperidin-3-ylethyl)benzamide
CID 62034679
3-chloro-5-methyl-N-(1-piperidin-3-ylethyl)benzamide
CID 81322966
5-bromo-N-(1-piperidin-3-ylethyl)thiophene-3-carboxamide
CID 113265499
N-(1-piperidin-3-ylethyl)-1,3-benzodioxole-5-carboxamide;hydrochloride
CID 119474135
N-[2-oxo-2-(1-piperidin-3-ylethylamino)ethyl]benzamide;hydrochloride
CID 119474128
2-oxo-N-(1-piperidin-3-ylethyl)-3,4-dihydro-1H-quinoline-6-carboxamide;hydrochloride
CID 119474020

Frequently Asked Questions

What is the IUPAC name of N-(1-piperidin-3-ylethyl)pyridine-4-carboxamide?
The IUPAC name of N-(1-piperidin-3-ylethyl)pyridine-4-carboxamide (CID 62032705) is N-(1-piperidin-3-ylethyl)pyridine-4-carboxamide.
What is the SMILES notation for N-(1-piperidin-3-ylethyl)pyridine-4-carboxamide?
The canonical SMILES for N-(1-piperidin-3-ylethyl)pyridine-4-carboxamide is CC(NC(=O)c1ccncc1)C1CCCNC1.
What is the InChIKey of N-(1-piperidin-3-ylethyl)pyridine-4-carboxamide?
The InChIKey is OOKAUYMZWJLLRR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3O/c1-10(12-3-2-6-15-9-12)16-13(17)11-4-7-14-8-5-11/h4-5,7-8,10,12,15H,2-3,6,9H2,1H3,(H,16,17).
What are the key properties of N-(1-piperidin-3-ylethyl)pyridine-4-carboxamide?
N-(1-piperidin-3-ylethyl)pyridine-4-carboxamide has a molecular weight of 233.31 g/mol, XLogP of 1.20, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-piperidin-3-ylethyl)pyridine-4-carboxamide is sourced from PubChem (CID 62032705), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).