N-(2-methoxy-3-pyridinyl)-5-oxo-1-(1-phenylethyl)pyrrolidine-3-carboxamide

C19H21N3O3 — CID 53499094

IUPACN-(2-methoxy-3-pyridinyl)-5-oxo-1-(1-phenylethyl)pyrrolidine-3-carboxamide
SMILESCOc1ncccc1NC(=O)C1CC(=O)N(C(C)c2ccccc2)C1
InChIInChI=1S/C19H21N3O3/c1-13(14-7-4-3-5-8-14)22-12-15(11-17(22)23)18(24)21-16-9-6-10-20-19(16)25-2/h3-10,13,15H,11-12H2,1-2H3,(H,21,24)
InChIKeyNEOZBCZDQWFJGK-UHFFFAOYSA-N
MW339.40 g/mol
LogP2.64
Rot. Bonds5

About N-(2-methoxy-3-pyridinyl)-5-oxo-1-(1-phenylethyl)pyrrolidine-3-carboxamide

N-(2-methoxy-3-pyridinyl)-5-oxo-1-(1-phenylethyl)pyrrolidine-3-carboxamide (PubChem CID 53499094) has the molecular formula C19H21N3O3 and a molecular weight of 339.40 g/mol. Its IUPAC name is N-(2-methoxy-3-pyridinyl)-5-oxo-1-(1-phenylethyl)pyrrolidine-3-carboxamide.

Molecular Properties

Compound NameN-(2-methoxy-3-pyridinyl)-5-oxo-1-(1-phenylethyl)pyrrolidine-3-carboxamide
PubChem CID53499094
Molecular FormulaC19H21N3O3
Molecular Weight339.40 g/mol
Exact Mass339.16
IUPAC NameN-(2-methoxy-3-pyridinyl)-5-oxo-1-(1-phenylethyl)pyrrolidine-3-carboxamide
SMILESCOc1ncccc1NC(=O)C1CC(=O)N(C(C)c2ccccc2)C1
InChIInChI=1S/C19H21N3O3/c1-13(14-7-4-3-5-8-14)22-12-15(11-17(22)23)18(24)21-16-9-6-10-20-19(16)25-2/h3-10,13,15H,11-12H2,1-2H3,(H,21,24)
InChIKeyNEOZBCZDQWFJGK-UHFFFAOYSA-N
XLogP2.64
TPSA71.53 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.40
LogP ≤ 52.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-(2-methoxy-3-pyridinyl)-5-oxo-1-(1-phenylethyl)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

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxy-3-pyridinyl)-5-oxo-1-(1-phenylethyl)pyrrolidine-3-carboxamide?
The IUPAC name of N-(2-methoxy-3-pyridinyl)-5-oxo-1-(1-phenylethyl)pyrrolidine-3-carboxamide (CID 53499094) is N-(2-methoxy-3-pyridinyl)-5-oxo-1-(1-phenylethyl)pyrrolidine-3-carboxamide.
What is the SMILES notation for N-(2-methoxy-3-pyridinyl)-5-oxo-1-(1-phenylethyl)pyrrolidine-3-carboxamide?
The canonical SMILES for N-(2-methoxy-3-pyridinyl)-5-oxo-1-(1-phenylethyl)pyrrolidine-3-carboxamide is COc1ncccc1NC(=O)C1CC(=O)N(C(C)c2ccccc2)C1.
What is the InChIKey of N-(2-methoxy-3-pyridinyl)-5-oxo-1-(1-phenylethyl)pyrrolidine-3-carboxamide?
The InChIKey is NEOZBCZDQWFJGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N3O3/c1-13(14-7-4-3-5-8-14)22-12-15(11-17(22)23)18(24)21-16-9-6-10-20-19(16)25-2/h3-10,13,15H,11-12H2,1-2H3,(H,21,24).
What are the key properties of N-(2-methoxy-3-pyridinyl)-5-oxo-1-(1-phenylethyl)pyrrolidine-3-carboxamide?
N-(2-methoxy-3-pyridinyl)-5-oxo-1-(1-phenylethyl)pyrrolidine-3-carboxamide has a molecular weight of 339.40 g/mol, XLogP of 2.64, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxy-3-pyridinyl)-5-oxo-1-(1-phenylethyl)pyrrolidine-3-carboxamide is sourced from PubChem (CID 53499094), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).