4-(2-oxo-1H-pyridin-3-yl)-2-[1-(pyridine-2-carbonyl)pyrrolidin-3-yl]-1H-pyrimidin-6-one

C19H17N5O3 — CID 136881792

IUPAC4-(2-oxo-1H-pyridin-3-yl)-2-[1-(pyridine-2-carbonyl)pyrrolidin-3-yl]-1H-pyrimidin-6-one
SMILESO=C(c1ccccn1)N1CCC(c2nc(-c3ccc[nH]c3=O)cc(=O)[nH]2)C1
InChIInChI=1S/C19H17N5O3/c25-16-10-15(13-4-3-8-21-18(13)26)22-17(23-16)12-6-9-24(11-12)19(27)14-5-1-2-7-20-14/h1-5,7-8,10,12H,6,9,11H2,(H,21,26)(H,22,23,25)
InChIKeyFAKPHSFTAZQVLI-UHFFFAOYSA-N
MW363.38 g/mol
LogP1.15
Rot. Bonds3

About 4-(2-oxo-1H-pyridin-3-yl)-2-[1-(pyridine-2-carbonyl)pyrrolidin-3-yl]-1H-pyrimidin-6-one

4-(2-oxo-1H-pyridin-3-yl)-2-[1-(pyridine-2-carbonyl)pyrrolidin-3-yl]-1H-pyrimidin-6-one (PubChem CID 136881792) has the molecular formula C19H17N5O3 and a molecular weight of 363.38 g/mol. Its IUPAC name is 4-(2-oxo-1H-pyridin-3-yl)-2-[1-(pyridine-2-carbonyl)pyrrolidin-3-yl]-1H-pyrimidin-6-one.

Molecular Properties

Compound Name4-(2-oxo-1H-pyridin-3-yl)-2-[1-(pyridine-2-carbonyl)pyrrolidin-3-yl]-1H-pyrimidin-6-one
PubChem CID136881792
Molecular FormulaC19H17N5O3
Molecular Weight363.38 g/mol
Exact Mass363.13
IUPAC Name4-(2-oxo-1H-pyridin-3-yl)-2-[1-(pyridine-2-carbonyl)pyrrolidin-3-yl]-1H-pyrimidin-6-one
SMILESO=C(c1ccccn1)N1CCC(c2nc(-c3ccc[nH]c3=O)cc(=O)[nH]2)C1
InChIInChI=1S/C19H17N5O3/c25-16-10-15(13-4-3-8-21-18(13)26)22-17(23-16)12-6-9-24(11-12)19(27)14-5-1-2-7-20-14/h1-5,7-8,10,12H,6,9,11H2,(H,21,26)(H,22,23,25)
InChIKeyFAKPHSFTAZQVLI-UHFFFAOYSA-N
XLogP1.15
TPSA111.81 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.38
LogP ≤ 51.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 4-(2-oxo-1H-pyridin-3-yl)-2-[1-(pyridine-2-carbonyl)pyrrolidin-3-yl]-1H-pyrimidin-6-one 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

2-[1-(2-fluorobenzoyl)pyrrolidin-3-yl]-4-(2-oxo-1H-pyridin-3-yl)-1H-pyrimidin-6-one
CID 136881857
2-[(3S)-1-(3-fluorobenzoyl)pyrrolidin-3-yl]-4-(2-oxo-1H-pyridin-3-yl)-1H-pyrimidin-6-one
CID 136815683
2-[(3S)-1-(2-oxo-1H-pyridine-4-carbonyl)pyrrolidin-3-yl]-4-pyridin-2-yl-1H-pyrimidin-6-one
CID 136682322
2-[(3R)-1-(2-methoxybenzoyl)pyrrolidin-3-yl]-4-(2-methoxy-3-pyridinyl)-1H-pyrimidin-6-one
CID 136850443
2-[(3R)-1-(2-fluorobenzoyl)pyrrolidin-3-yl]-4-(2-methoxy-3-pyridinyl)-1H-pyrimidin-6-one
CID 136869687
4-pyridin-2-yl-2-[(3R)-1-(3,4,5-trimethoxybenzoyl)pyrrolidin-3-yl]-1H-pyrimidin-6-one
CID 136735357
2-[1-(2-ethoxybenzoyl)pyrrolidin-3-yl]-4-(2-methoxy-3-pyridinyl)-1H-pyrimidin-6-one
CID 136881771
2-[(3R)-1-(3-methoxybenzoyl)pyrrolidin-3-yl]-4-(2-methoxy-3-pyridinyl)-1H-pyrimidin-6-one
CID 136850305
2-[(3R)-1-(3,4-difluorobenzoyl)pyrrolidin-3-yl]-4-(2-methoxy-3-pyridinyl)-1H-pyrimidin-6-one
CID 136869681
2-[(3R)-1-(pyridine-3-carbonyl)piperidin-3-yl]-4-pyridin-2-yl-1H-pyrimidin-6-one
CID 136678872
2-[(3S)-1-(2,5-dimethoxybenzoyl)pyrrolidin-3-yl]-4-(2-methoxy-3-pyridinyl)-1H-pyrimidin-6-one
CID 136735402
2-[(3S)-1-(1-methylpyrazole-3-carbonyl)pyrrolidin-3-yl]-4-pyridin-3-yl-1H-pyrimidin-6-one
CID 136764031

Frequently Asked Questions

What is the IUPAC name of 4-(2-oxo-1H-pyridin-3-yl)-2-[1-(pyridine-2-carbonyl)pyrrolidin-3-yl]-1H-pyrimidin-6-one?
The IUPAC name of 4-(2-oxo-1H-pyridin-3-yl)-2-[1-(pyridine-2-carbonyl)pyrrolidin-3-yl]-1H-pyrimidin-6-one (CID 136881792) is 4-(2-oxo-1H-pyridin-3-yl)-2-[1-(pyridine-2-carbonyl)pyrrolidin-3-yl]-1H-pyrimidin-6-one.
What is the SMILES notation for 4-(2-oxo-1H-pyridin-3-yl)-2-[1-(pyridine-2-carbonyl)pyrrolidin-3-yl]-1H-pyrimidin-6-one?
The canonical SMILES for 4-(2-oxo-1H-pyridin-3-yl)-2-[1-(pyridine-2-carbonyl)pyrrolidin-3-yl]-1H-pyrimidin-6-one is O=C(c1ccccn1)N1CCC(c2nc(-c3ccc[nH]c3=O)cc(=O)[nH]2)C1.
What is the InChIKey of 4-(2-oxo-1H-pyridin-3-yl)-2-[1-(pyridine-2-carbonyl)pyrrolidin-3-yl]-1H-pyrimidin-6-one?
The InChIKey is FAKPHSFTAZQVLI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17N5O3/c25-16-10-15(13-4-3-8-21-18(13)26)22-17(23-16)12-6-9-24(11-12)19(27)14-5-1-2-7-20-14/h1-5,7-8,10,12H,6,9,11H2,(H,21,26)(H,22,23,25).
What are the key properties of 4-(2-oxo-1H-pyridin-3-yl)-2-[1-(pyridine-2-carbonyl)pyrrolidin-3-yl]-1H-pyrimidin-6-one?
4-(2-oxo-1H-pyridin-3-yl)-2-[1-(pyridine-2-carbonyl)pyrrolidin-3-yl]-1H-pyrimidin-6-one has a molecular weight of 363.38 g/mol, XLogP of 1.15, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-oxo-1H-pyridin-3-yl)-2-[1-(pyridine-2-carbonyl)pyrrolidin-3-yl]-1H-pyrimidin-6-one is sourced from PubChem (CID 136881792), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).