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N-(2-piperidin-4-ylethyl)pyridine-2-carboxamide

C13H19N3O — CID 21497163

Data last refreshed: (MolForge compound catalog, from PubChem)

IUPACN-(2-piperidin-4-ylethyl)pyridine-2-carboxamide
SMILESO=C(NCCC1CCNCC1)c1ccccn1
InChIInChI=1S/C13H19N3O/c17-13(12-3-1-2-7-15-12)16-10-6-11-4-8-14-9-5-11/h1-3,7,11,14H,4-6,8-10H2,(H,16,17)
InChIKeyWJLFTQYAHPWRED-UHFFFAOYSA-N
MW233.31 g/mol
LogP1.20
Rot. Bonds4

About N-(2-piperidin-4-ylethyl)pyridine-2-carboxamide

N-(2-piperidin-4-ylethyl)pyridine-2-carboxamide (PubChem CID 21497163) has the molecular formula C13H19N3O and a molecular weight of 233.31 g/mol. Its IUPAC name is N-(2-piperidin-4-ylethyl)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-(2-piperidin-4-ylethyl)pyridine-2-carboxamide
PubChem CID21497163
Molecular FormulaC13H19N3O
Molecular Weight233.31 g/mol
Exact Mass233.15
IUPAC NameN-(2-piperidin-4-ylethyl)pyridine-2-carboxamide
SMILESO=C(NCCC1CCNCC1)c1ccccn1
InChIInChI=1S/C13H19N3O/c17-13(12-3-1-2-7-15-12)16-10-6-11-4-8-14-9-5-11/h1-3,7,11,14H,4-6,8-10H2,(H,16,17)
InChIKeyWJLFTQYAHPWRED-UHFFFAOYSA-N
XLogP1.20
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
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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Frequently Asked Questions

What is the IUPAC name of N-(2-piperidin-4-ylethyl)pyridine-2-carboxamide?
The IUPAC name of N-(2-piperidin-4-ylethyl)pyridine-2-carboxamide (CID 21497163) is N-(2-piperidin-4-ylethyl)pyridine-2-carboxamide.
What is the SMILES notation for N-(2-piperidin-4-ylethyl)pyridine-2-carboxamide?
The canonical SMILES for N-(2-piperidin-4-ylethyl)pyridine-2-carboxamide is O=C(NCCC1CCNCC1)c1ccccn1.
What is the InChIKey of N-(2-piperidin-4-ylethyl)pyridine-2-carboxamide?
The InChIKey is WJLFTQYAHPWRED-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3O/c17-13(12-3-1-2-7-15-12)16-10-6-11-4-8-14-9-5-11/h1-3,7,11,14H,4-6,8-10H2,(H,16,17).
What are the key properties of N-(2-piperidin-4-ylethyl)pyridine-2-carboxamide?
N-(2-piperidin-4-ylethyl)pyridine-2-carboxamide has a molecular weight of 233.31 g/mol, XLogP of 1.20, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-piperidin-4-ylethyl)pyridine-2-carboxamide is sourced from PubChem (CID 21497163), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

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