N-[(6-methyl-2-pyridinyl)methyl]-5-oxopyrrolidine-3-carboxamide

C12H15N3O2 — CID 78983299

IUPACN-[(6-methyl-2-pyridinyl)methyl]-5-oxopyrrolidine-3-carboxamide
SMILESCc1cccc(CNC(=O)C2CNC(=O)C2)n1
InChIInChI=1S/C12H15N3O2/c1-8-3-2-4-10(15-8)7-14-12(17)9-5-11(16)13-6-9/h2-4,9H,5-7H2,1H3,(H,13,16)(H,14,17)
InChIKeyIHUVJGHCDOYCHZ-UHFFFAOYSA-N
MW233.27 g/mol
LogP0.14
Rot. Bonds3

About N-[(6-methyl-2-pyridinyl)methyl]-5-oxopyrrolidine-3-carboxamide

N-[(6-methyl-2-pyridinyl)methyl]-5-oxopyrrolidine-3-carboxamide (PubChem CID 78983299) has the molecular formula C12H15N3O2 and a molecular weight of 233.27 g/mol. Its IUPAC name is N-[(6-methyl-2-pyridinyl)methyl]-5-oxopyrrolidine-3-carboxamide.

Molecular Properties

Compound NameN-[(6-methyl-2-pyridinyl)methyl]-5-oxopyrrolidine-3-carboxamide
PubChem CID78983299
Molecular FormulaC12H15N3O2
Molecular Weight233.27 g/mol
Exact Mass233.12
IUPAC NameN-[(6-methyl-2-pyridinyl)methyl]-5-oxopyrrolidine-3-carboxamide
SMILESCc1cccc(CNC(=O)C2CNC(=O)C2)n1
InChIInChI=1S/C12H15N3O2/c1-8-3-2-4-10(15-8)7-14-12(17)9-5-11(16)13-6-9/h2-4,9H,5-7H2,1H3,(H,13,16)(H,14,17)
InChIKeyIHUVJGHCDOYCHZ-UHFFFAOYSA-N
XLogP0.14
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.27
LogP ≤ 50.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-[(6-methyl-2-pyridinyl)methyl]-5-oxopyrrolidine-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-[(6-methyl-2-pyridinyl)methyl]cyclopropanecarboxamide
CID 61150907
5-oxo-N-(pyridin-4-ylmethyl)pyrrolidine-3-carboxamide
CID 78982237
2-methyl-N-[(6-methyl-2-pyridinyl)methyl]pyrrolidine-3-carboxamide
CID 79384606
2-[[(5-oxopyrrolidine-3-carbonyl)amino]methyl]pyridine-4-carboxylic acid
CID 83193579
5-oxo-N-(1H-pyrazol-5-ylmethyl)pyrrolidine-3-carboxamide
CID 78983105
5-oxo-N-(1,3-thiazol-2-ylmethyl)pyrrolidine-3-carboxamide
CID 78983445
N-[(6-methyl-2-pyridinyl)methyl]-2-phenylcyclopropane-1-carboxamide
CID 86841366
N-[(4-chlorophenyl)methyl]-5-oxopyrrolidine-3-carboxamide
CID 78981486
2-[(6-methyl-2-pyridinyl)methylamino]-2-oxoacetic acid
CID 62306859
1-[(6-methyl-2-pyridinyl)methylcarbamoyl]cyclobutane-1-carboxylic acid
CID 62307208
4-[(6-methyl-2-pyridinyl)methylamino]azepan-2-one
CID 63887494
N-[(6-methyl-2-pyridinyl)methyl]-1-(2-nitrophenyl)piperidine-4-carboxamide
CID 87041286

Frequently Asked Questions

What is the IUPAC name of N-[(6-methyl-2-pyridinyl)methyl]-5-oxopyrrolidine-3-carboxamide?
The IUPAC name of N-[(6-methyl-2-pyridinyl)methyl]-5-oxopyrrolidine-3-carboxamide (CID 78983299) is N-[(6-methyl-2-pyridinyl)methyl]-5-oxopyrrolidine-3-carboxamide.
What is the SMILES notation for N-[(6-methyl-2-pyridinyl)methyl]-5-oxopyrrolidine-3-carboxamide?
The canonical SMILES for N-[(6-methyl-2-pyridinyl)methyl]-5-oxopyrrolidine-3-carboxamide is Cc1cccc(CNC(=O)C2CNC(=O)C2)n1.
What is the InChIKey of N-[(6-methyl-2-pyridinyl)methyl]-5-oxopyrrolidine-3-carboxamide?
The InChIKey is IHUVJGHCDOYCHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N3O2/c1-8-3-2-4-10(15-8)7-14-12(17)9-5-11(16)13-6-9/h2-4,9H,5-7H2,1H3,(H,13,16)(H,14,17).
What are the key properties of N-[(6-methyl-2-pyridinyl)methyl]-5-oxopyrrolidine-3-carboxamide?
N-[(6-methyl-2-pyridinyl)methyl]-5-oxopyrrolidine-3-carboxamide has a molecular weight of 233.27 g/mol, XLogP of 0.14, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(6-methyl-2-pyridinyl)methyl]-5-oxopyrrolidine-3-carboxamide is sourced from PubChem (CID 78983299), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).