N-(2-oxo-1H-pyridin-3-yl)pyrrolidine-1-carboxamide

C10H13N3O2 — CID 127578109

IUPACN-(2-oxo-1H-pyridin-3-yl)pyrrolidine-1-carboxamide
SMILESO=C(Nc1ccc[nH]c1=O)N1CCCC1
InChIInChI=1S/C10H13N3O2/c14-9-8(4-3-5-11-9)12-10(15)13-6-1-2-7-13/h3-5H,1-2,6-7H2,(H,11,14)(H,12,15)
InChIKeyKPHQAANMUCFCNL-UHFFFAOYSA-N
MW207.23 g/mol
LogP1.00
Rot. Bonds1

About N-(2-oxo-1H-pyridin-3-yl)pyrrolidine-1-carboxamide

N-(2-oxo-1H-pyridin-3-yl)pyrrolidine-1-carboxamide (PubChem CID 127578109) has the molecular formula C10H13N3O2 and a molecular weight of 207.23 g/mol. Its IUPAC name is N-(2-oxo-1H-pyridin-3-yl)pyrrolidine-1-carboxamide.

Molecular Properties

Compound NameN-(2-oxo-1H-pyridin-3-yl)pyrrolidine-1-carboxamide
PubChem CID127578109
Molecular FormulaC10H13N3O2
Molecular Weight207.23 g/mol
Exact Mass207.10
IUPAC NameN-(2-oxo-1H-pyridin-3-yl)pyrrolidine-1-carboxamide
SMILESO=C(Nc1ccc[nH]c1=O)N1CCCC1
InChIInChI=1S/C10H13N3O2/c14-9-8(4-3-5-11-9)12-10(15)13-6-1-2-7-13/h3-5H,1-2,6-7H2,(H,11,14)(H,12,15)
InChIKeyKPHQAANMUCFCNL-UHFFFAOYSA-N
XLogP1.00
TPSA65.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.23
LogP ≤ 51.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(2-oxo-1H-pyridin-3-yl)pyrrolidine-1-carboxamide?
The IUPAC name of N-(2-oxo-1H-pyridin-3-yl)pyrrolidine-1-carboxamide (CID 127578109) is N-(2-oxo-1H-pyridin-3-yl)pyrrolidine-1-carboxamide.
What is the SMILES notation for N-(2-oxo-1H-pyridin-3-yl)pyrrolidine-1-carboxamide?
The canonical SMILES for N-(2-oxo-1H-pyridin-3-yl)pyrrolidine-1-carboxamide is O=C(Nc1ccc[nH]c1=O)N1CCCC1.
What is the InChIKey of N-(2-oxo-1H-pyridin-3-yl)pyrrolidine-1-carboxamide?
The InChIKey is KPHQAANMUCFCNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N3O2/c14-9-8(4-3-5-11-9)12-10(15)13-6-1-2-7-13/h3-5H,1-2,6-7H2,(H,11,14)(H,12,15).
What are the key properties of N-(2-oxo-1H-pyridin-3-yl)pyrrolidine-1-carboxamide?
N-(2-oxo-1H-pyridin-3-yl)pyrrolidine-1-carboxamide has a molecular weight of 207.23 g/mol, XLogP of 1.00, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-oxo-1H-pyridin-3-yl)pyrrolidine-1-carboxamide is sourced from PubChem (CID 127578109), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).