6-(piperidin-1-ylmethyl)pyridine-2-carboxamide

C12H17N3O — CID 66911251

IUPAC6-(piperidin-1-ylmethyl)pyridine-2-carboxamide
SMILESNC(=O)c1cccc(CN2CCCCC2)n1
InChIInChI=1S/C12H17N3O/c13-12(16)11-6-4-5-10(14-11)9-15-7-2-1-3-8-15/h4-6H,1-3,7-9H2,(H2,13,16)
InChIKeyNHNZFHOUTOKNLK-UHFFFAOYSA-N
MW219.29 g/mol
LogP1.17
Rot. Bonds3

About 6-(piperidin-1-ylmethyl)pyridine-2-carboxamide

6-(piperidin-1-ylmethyl)pyridine-2-carboxamide (PubChem CID 66911251) has the molecular formula C12H17N3O and a molecular weight of 219.29 g/mol. Its IUPAC name is 6-(piperidin-1-ylmethyl)pyridine-2-carboxamide.

Molecular Properties

Compound Name6-(piperidin-1-ylmethyl)pyridine-2-carboxamide
PubChem CID66911251
Molecular FormulaC12H17N3O
Molecular Weight219.29 g/mol
Exact Mass219.14
IUPAC Name6-(piperidin-1-ylmethyl)pyridine-2-carboxamide
SMILESNC(=O)c1cccc(CN2CCCCC2)n1
InChIInChI=1S/C12H17N3O/c13-12(16)11-6-4-5-10(14-11)9-15-7-2-1-3-8-15/h4-6H,1-3,7-9H2,(H2,13,16)
InChIKeyNHNZFHOUTOKNLK-UHFFFAOYSA-N
XLogP1.17
TPSA59.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.29
LogP ≤ 51.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-(piperidin-1-ylmethyl)pyridine-2-carboxamide?
The IUPAC name of 6-(piperidin-1-ylmethyl)pyridine-2-carboxamide (CID 66911251) is 6-(piperidin-1-ylmethyl)pyridine-2-carboxamide.
What is the SMILES notation for 6-(piperidin-1-ylmethyl)pyridine-2-carboxamide?
The canonical SMILES for 6-(piperidin-1-ylmethyl)pyridine-2-carboxamide is NC(=O)c1cccc(CN2CCCCC2)n1.
What is the InChIKey of 6-(piperidin-1-ylmethyl)pyridine-2-carboxamide?
The InChIKey is NHNZFHOUTOKNLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17N3O/c13-12(16)11-6-4-5-10(14-11)9-15-7-2-1-3-8-15/h4-6H,1-3,7-9H2,(H2,13,16).
What are the key properties of 6-(piperidin-1-ylmethyl)pyridine-2-carboxamide?
6-(piperidin-1-ylmethyl)pyridine-2-carboxamide has a molecular weight of 219.29 g/mol, XLogP of 1.17, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(piperidin-1-ylmethyl)pyridine-2-carboxamide is sourced from PubChem (CID 66911251), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).