N-(1-methyl-2-oxopyrrolidin-3-yl)-2-oxo-1H-pyridine-4-carboxamide

C11H13N3O3 — CID 113257175

IUPACN-(1-methyl-2-oxopyrrolidin-3-yl)-2-oxo-1H-pyridine-4-carboxamide
SMILESCN1CCC(NC(=O)c2cc[nH]c(=O)c2)C1=O
InChIInChI=1S/C11H13N3O3/c1-14-5-3-8(11(14)17)13-10(16)7-2-4-12-9(15)6-7/h2,4,6,8H,3,5H2,1H3,(H,12,15)(H,13,16)
InChIKeyXOUDDBLBIKBNLY-UHFFFAOYSA-N
MW235.24 g/mol
LogP-0.66
Rot. Bonds2

About N-(1-methyl-2-oxopyrrolidin-3-yl)-2-oxo-1H-pyridine-4-carboxamide

N-(1-methyl-2-oxopyrrolidin-3-yl)-2-oxo-1H-pyridine-4-carboxamide (PubChem CID 113257175) has the molecular formula C11H13N3O3 and a molecular weight of 235.24 g/mol. Its IUPAC name is N-(1-methyl-2-oxopyrrolidin-3-yl)-2-oxo-1H-pyridine-4-carboxamide.

Molecular Properties

Compound NameN-(1-methyl-2-oxopyrrolidin-3-yl)-2-oxo-1H-pyridine-4-carboxamide
PubChem CID113257175
Molecular FormulaC11H13N3O3
Molecular Weight235.24 g/mol
Exact Mass235.10
IUPAC NameN-(1-methyl-2-oxopyrrolidin-3-yl)-2-oxo-1H-pyridine-4-carboxamide
SMILESCN1CCC(NC(=O)c2cc[nH]c(=O)c2)C1=O
InChIInChI=1S/C11H13N3O3/c1-14-5-3-8(11(14)17)13-10(16)7-2-4-12-9(15)6-7/h2,4,6,8H,3,5H2,1H3,(H,12,15)(H,13,16)
InChIKeyXOUDDBLBIKBNLY-UHFFFAOYSA-N
XLogP-0.66
TPSA82.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.24
LogP ≤ 5-0.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(1-methyl-2-oxopyrrolidin-3-yl)-2-oxo-1H-pyridine-4-carboxamide?
The IUPAC name of N-(1-methyl-2-oxopyrrolidin-3-yl)-2-oxo-1H-pyridine-4-carboxamide (CID 113257175) is N-(1-methyl-2-oxopyrrolidin-3-yl)-2-oxo-1H-pyridine-4-carboxamide.
What is the SMILES notation for N-(1-methyl-2-oxopyrrolidin-3-yl)-2-oxo-1H-pyridine-4-carboxamide?
The canonical SMILES for N-(1-methyl-2-oxopyrrolidin-3-yl)-2-oxo-1H-pyridine-4-carboxamide is CN1CCC(NC(=O)c2cc[nH]c(=O)c2)C1=O.
What is the InChIKey of N-(1-methyl-2-oxopyrrolidin-3-yl)-2-oxo-1H-pyridine-4-carboxamide?
The InChIKey is XOUDDBLBIKBNLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N3O3/c1-14-5-3-8(11(14)17)13-10(16)7-2-4-12-9(15)6-7/h2,4,6,8H,3,5H2,1H3,(H,12,15)(H,13,16).
What are the key properties of N-(1-methyl-2-oxopyrrolidin-3-yl)-2-oxo-1H-pyridine-4-carboxamide?
N-(1-methyl-2-oxopyrrolidin-3-yl)-2-oxo-1H-pyridine-4-carboxamide has a molecular weight of 235.24 g/mol, XLogP of -0.66, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-methyl-2-oxopyrrolidin-3-yl)-2-oxo-1H-pyridine-4-carboxamide is sourced from PubChem (CID 113257175), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).