N-(4-oxo-1H-pyridin-3-yl)piperidine-4-carboxamide

C11H15N3O2 — CID 46299655

IUPACN-(4-oxo-1H-pyridin-3-yl)piperidine-4-carboxamide
SMILESO=C(Nc1c[nH]ccc1=O)C1CCNCC1
InChIInChI=1S/C11H15N3O2/c15-10-3-6-13-7-9(10)14-11(16)8-1-4-12-5-2-8/h3,6-8,12H,1-2,4-5H2,(H,13,15)(H,14,16)
InChIKeyRTIXQTGOBQHCKV-UHFFFAOYSA-N
MW221.26 g/mol
LogP0.31
Rot. Bonds2

About N-(4-oxo-1H-pyridin-3-yl)piperidine-4-carboxamide

N-(4-oxo-1H-pyridin-3-yl)piperidine-4-carboxamide (PubChem CID 46299655) has the molecular formula C11H15N3O2 and a molecular weight of 221.26 g/mol. Its IUPAC name is N-(4-oxo-1H-pyridin-3-yl)piperidine-4-carboxamide.

Molecular Properties

Compound NameN-(4-oxo-1H-pyridin-3-yl)piperidine-4-carboxamide
PubChem CID46299655
Molecular FormulaC11H15N3O2
Molecular Weight221.26 g/mol
Exact Mass221.12
IUPAC NameN-(4-oxo-1H-pyridin-3-yl)piperidine-4-carboxamide
SMILESO=C(Nc1c[nH]ccc1=O)C1CCNCC1
InChIInChI=1S/C11H15N3O2/c15-10-3-6-13-7-9(10)14-11(16)8-1-4-12-5-2-8/h3,6-8,12H,1-2,4-5H2,(H,13,15)(H,14,16)
InChIKeyRTIXQTGOBQHCKV-UHFFFAOYSA-N
XLogP0.31
TPSA73.99 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.26
LogP ≤ 50.31
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(4-oxo-1H-pyridin-3-yl)piperidine-4-carboxamide?
The IUPAC name of N-(4-oxo-1H-pyridin-3-yl)piperidine-4-carboxamide (CID 46299655) is N-(4-oxo-1H-pyridin-3-yl)piperidine-4-carboxamide.
What is the SMILES notation for N-(4-oxo-1H-pyridin-3-yl)piperidine-4-carboxamide?
The canonical SMILES for N-(4-oxo-1H-pyridin-3-yl)piperidine-4-carboxamide is O=C(Nc1c[nH]ccc1=O)C1CCNCC1.
What is the InChIKey of N-(4-oxo-1H-pyridin-3-yl)piperidine-4-carboxamide?
The InChIKey is RTIXQTGOBQHCKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3O2/c15-10-3-6-13-7-9(10)14-11(16)8-1-4-12-5-2-8/h3,6-8,12H,1-2,4-5H2,(H,13,15)(H,14,16).
What are the key properties of N-(4-oxo-1H-pyridin-3-yl)piperidine-4-carboxamide?
N-(4-oxo-1H-pyridin-3-yl)piperidine-4-carboxamide has a molecular weight of 221.26 g/mol, XLogP of 0.31, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-oxo-1H-pyridin-3-yl)piperidine-4-carboxamide is sourced from PubChem (CID 46299655), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).