N-methyl-6-oxo-1-(2-oxo-2-pyrrolidin-1-ylethyl)pyridine-3-carboxamide

C13H17N3O3 — CID 47394449

IUPACN-methyl-6-oxo-1-(2-oxo-2-pyrrolidin-1-ylethyl)pyridine-3-carboxamide
SMILESCNC(=O)c1ccc(=O)n(CC(=O)N2CCCC2)c1
InChIInChI=1S/C13H17N3O3/c1-14-13(19)10-4-5-11(17)16(8-10)9-12(18)15-6-2-3-7-15/h4-5,8H,2-3,6-7,9H2,1H3,(H,14,19)
InChIKeyZISNQJGIFCFMKI-UHFFFAOYSA-N
MW263.30 g/mol
LogP-0.17
Rot. Bonds3

About N-methyl-6-oxo-1-(2-oxo-2-pyrrolidin-1-ylethyl)pyridine-3-carboxamide

N-methyl-6-oxo-1-(2-oxo-2-pyrrolidin-1-ylethyl)pyridine-3-carboxamide (PubChem CID 47394449) has the molecular formula C13H17N3O3 and a molecular weight of 263.30 g/mol. Its IUPAC name is N-methyl-6-oxo-1-(2-oxo-2-pyrrolidin-1-ylethyl)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-methyl-6-oxo-1-(2-oxo-2-pyrrolidin-1-ylethyl)pyridine-3-carboxamide
PubChem CID47394449
Molecular FormulaC13H17N3O3
Molecular Weight263.30 g/mol
Exact Mass263.13
IUPAC NameN-methyl-6-oxo-1-(2-oxo-2-pyrrolidin-1-ylethyl)pyridine-3-carboxamide
SMILESCNC(=O)c1ccc(=O)n(CC(=O)N2CCCC2)c1
InChIInChI=1S/C13H17N3O3/c1-14-13(19)10-4-5-11(17)16(8-10)9-12(18)15-6-2-3-7-15/h4-5,8H,2-3,6-7,9H2,1H3,(H,14,19)
InChIKeyZISNQJGIFCFMKI-UHFFFAOYSA-N
XLogP-0.17
TPSA71.41 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.30
LogP ≤ 5-0.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-methyl-6-oxo-1-(2-oxo-2-pyrrolidin-1-ylethyl)pyridine-3-carboxamide?
The IUPAC name of N-methyl-6-oxo-1-(2-oxo-2-pyrrolidin-1-ylethyl)pyridine-3-carboxamide (CID 47394449) is N-methyl-6-oxo-1-(2-oxo-2-pyrrolidin-1-ylethyl)pyridine-3-carboxamide.
What is the SMILES notation for N-methyl-6-oxo-1-(2-oxo-2-pyrrolidin-1-ylethyl)pyridine-3-carboxamide?
The canonical SMILES for N-methyl-6-oxo-1-(2-oxo-2-pyrrolidin-1-ylethyl)pyridine-3-carboxamide is CNC(=O)c1ccc(=O)n(CC(=O)N2CCCC2)c1.
What is the InChIKey of N-methyl-6-oxo-1-(2-oxo-2-pyrrolidin-1-ylethyl)pyridine-3-carboxamide?
The InChIKey is ZISNQJGIFCFMKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N3O3/c1-14-13(19)10-4-5-11(17)16(8-10)9-12(18)15-6-2-3-7-15/h4-5,8H,2-3,6-7,9H2,1H3,(H,14,19).
What are the key properties of N-methyl-6-oxo-1-(2-oxo-2-pyrrolidin-1-ylethyl)pyridine-3-carboxamide?
N-methyl-6-oxo-1-(2-oxo-2-pyrrolidin-1-ylethyl)pyridine-3-carboxamide has a molecular weight of 263.30 g/mol, XLogP of -0.17, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-6-oxo-1-(2-oxo-2-pyrrolidin-1-ylethyl)pyridine-3-carboxamide is sourced from PubChem (CID 47394449), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).