5-oxo-N-(pyridin-4-ylmethyl)pyrrolidine-3-carboxamide

C11H13N3O2 — CID 78982237

IUPAC5-oxo-N-(pyridin-4-ylmethyl)pyrrolidine-3-carboxamide
SMILESO=C1CC(C(=O)NCc2ccncc2)CN1
InChIInChI=1S/C11H13N3O2/c15-10-5-9(7-13-10)11(16)14-6-8-1-3-12-4-2-8/h1-4,9H,5-7H2,(H,13,15)(H,14,16)
InChIKeyYWGSTEBCYUGNIV-UHFFFAOYSA-N
MW219.24 g/mol
LogP-0.17
Rot. Bonds3

About 5-oxo-N-(pyridin-4-ylmethyl)pyrrolidine-3-carboxamide

5-oxo-N-(pyridin-4-ylmethyl)pyrrolidine-3-carboxamide (PubChem CID 78982237) has the molecular formula C11H13N3O2 and a molecular weight of 219.24 g/mol. Its IUPAC name is 5-oxo-N-(pyridin-4-ylmethyl)pyrrolidine-3-carboxamide.

Molecular Properties

Compound Name5-oxo-N-(pyridin-4-ylmethyl)pyrrolidine-3-carboxamide
PubChem CID78982237
Molecular FormulaC11H13N3O2
Molecular Weight219.24 g/mol
Exact Mass219.10
IUPAC Name5-oxo-N-(pyridin-4-ylmethyl)pyrrolidine-3-carboxamide
SMILESO=C1CC(C(=O)NCc2ccncc2)CN1
InChIInChI=1S/C11H13N3O2/c15-10-5-9(7-13-10)11(16)14-6-8-1-3-12-4-2-8/h1-4,9H,5-7H2,(H,13,15)(H,14,16)
InChIKeyYWGSTEBCYUGNIV-UHFFFAOYSA-N
XLogP-0.17
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.24
LogP ≤ 5-0.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 5-oxo-N-(pyridin-4-ylmethyl)pyrrolidine-3-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[(4-chlorophenyl)methyl]-5-oxopyrrolidine-3-carboxamide
CID 78981486
methyl 4-[[(5-oxopyrrolidine-3-carbonyl)amino]methyl]benzoate
CID 78981862
5-oxo-N-(1H-pyrazol-5-ylmethyl)pyrrolidine-3-carboxamide
CID 78983105
1-N-[(4-fluorophenyl)methyl]-4-N-(pyridin-4-ylmethyl)cyclohexane-1,4-dicarboxamide
CID 109148415
N-(pyridin-4-ylmethyl)piperidine-3-carboxamide;hydrochloride
CID 56832251
5-oxo-N-(1,3-thiazol-2-ylmethyl)pyrrolidine-3-carboxamide
CID 78983445
N-[[4-[4-(diethylamino)anilino]phenyl]methyl]-5-oxopyrrolidine-3-carboxamide
CID 166062467
N-[(6-methyl-2-pyridinyl)methyl]-5-oxopyrrolidine-3-carboxamide
CID 78983299
5-oxo-N-(2H-tetrazol-5-ylmethyl)pyrrolidine-3-carboxamide
CID 78954241
1-(4-fluorophenyl)-5-oxo-N-(pyridin-4-ylmethyl)pyrrolidine-3-carboxamide
CID 6458569
N-(1,2,4-oxadiazol-3-ylmethyl)-5-oxopyrrolidine-3-carboxamide
CID 106406327
N-[(6-methyl-3-pyridinyl)methyl]-6-oxopiperidine-3-carboxamide
CID 113223600

Frequently Asked Questions

What is the IUPAC name of 5-oxo-N-(pyridin-4-ylmethyl)pyrrolidine-3-carboxamide?
The IUPAC name of 5-oxo-N-(pyridin-4-ylmethyl)pyrrolidine-3-carboxamide (CID 78982237) is 5-oxo-N-(pyridin-4-ylmethyl)pyrrolidine-3-carboxamide.
What is the SMILES notation for 5-oxo-N-(pyridin-4-ylmethyl)pyrrolidine-3-carboxamide?
The canonical SMILES for 5-oxo-N-(pyridin-4-ylmethyl)pyrrolidine-3-carboxamide is O=C1CC(C(=O)NCc2ccncc2)CN1.
What is the InChIKey of 5-oxo-N-(pyridin-4-ylmethyl)pyrrolidine-3-carboxamide?
The InChIKey is YWGSTEBCYUGNIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N3O2/c15-10-5-9(7-13-10)11(16)14-6-8-1-3-12-4-2-8/h1-4,9H,5-7H2,(H,13,15)(H,14,16).
What are the key properties of 5-oxo-N-(pyridin-4-ylmethyl)pyrrolidine-3-carboxamide?
5-oxo-N-(pyridin-4-ylmethyl)pyrrolidine-3-carboxamide has a molecular weight of 219.24 g/mol, XLogP of -0.17, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-oxo-N-(pyridin-4-ylmethyl)pyrrolidine-3-carboxamide is sourced from PubChem (CID 78982237), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).