1-(2-fluorophenyl)-4-hydroxy-N-(3-oxo-3-pyrrolidin-1-ylpropyl)pyrazole-3-carboxamide

C17H19FN4O3 — CID 71933321

IUPAC1-(2-fluorophenyl)-4-hydroxy-N-(3-oxo-3-pyrrolidin-1-ylpropyl)pyrazole-3-carboxamide
SMILESO=C(NCCC(=O)N1CCCC1)c1nn(-c2ccccc2F)cc1O
InChIInChI=1S/C17H19FN4O3/c18-12-5-1-2-6-13(12)22-11-14(23)16(20-22)17(25)19-8-7-15(24)21-9-3-4-10-21/h1-2,5-6,11,23H,3-4,7-10H2,(H,19,25)
InChIKeyCHGAGVZPTRHACB-UHFFFAOYSA-N
MW346.36 g/mol
LogP1.46
Rot. Bonds5

About 1-(2-fluorophenyl)-4-hydroxy-N-(3-oxo-3-pyrrolidin-1-ylpropyl)pyrazole-3-carboxamide

1-(2-fluorophenyl)-4-hydroxy-N-(3-oxo-3-pyrrolidin-1-ylpropyl)pyrazole-3-carboxamide (PubChem CID 71933321) has the molecular formula C17H19FN4O3 and a molecular weight of 346.36 g/mol. Its IUPAC name is 1-(2-fluorophenyl)-4-hydroxy-N-(3-oxo-3-pyrrolidin-1-ylpropyl)pyrazole-3-carboxamide.

Molecular Properties

Compound Name1-(2-fluorophenyl)-4-hydroxy-N-(3-oxo-3-pyrrolidin-1-ylpropyl)pyrazole-3-carboxamide
PubChem CID71933321
Molecular FormulaC17H19FN4O3
Molecular Weight346.36 g/mol
Exact Mass346.14
IUPAC Name1-(2-fluorophenyl)-4-hydroxy-N-(3-oxo-3-pyrrolidin-1-ylpropyl)pyrazole-3-carboxamide
SMILESO=C(NCCC(=O)N1CCCC1)c1nn(-c2ccccc2F)cc1O
InChIInChI=1S/C17H19FN4O3/c18-12-5-1-2-6-13(12)22-11-14(23)16(20-22)17(25)19-8-7-15(24)21-9-3-4-10-21/h1-2,5-6,11,23H,3-4,7-10H2,(H,19,25)
InChIKeyCHGAGVZPTRHACB-UHFFFAOYSA-N
XLogP1.46
TPSA87.46 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.36
LogP ≤ 51.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 1-(2-fluorophenyl)-4-hydroxy-N-(3-oxo-3-pyrrolidin-1-ylpropyl)pyrazole-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 1-(2-fluorophenyl)-4-hydroxy-N-(3-oxo-3-pyrrolidin-1-ylpropyl)pyrazole-3-carboxamide?
The IUPAC name of 1-(2-fluorophenyl)-4-hydroxy-N-(3-oxo-3-pyrrolidin-1-ylpropyl)pyrazole-3-carboxamide (CID 71933321) is 1-(2-fluorophenyl)-4-hydroxy-N-(3-oxo-3-pyrrolidin-1-ylpropyl)pyrazole-3-carboxamide.
What is the SMILES notation for 1-(2-fluorophenyl)-4-hydroxy-N-(3-oxo-3-pyrrolidin-1-ylpropyl)pyrazole-3-carboxamide?
The canonical SMILES for 1-(2-fluorophenyl)-4-hydroxy-N-(3-oxo-3-pyrrolidin-1-ylpropyl)pyrazole-3-carboxamide is O=C(NCCC(=O)N1CCCC1)c1nn(-c2ccccc2F)cc1O.
What is the InChIKey of 1-(2-fluorophenyl)-4-hydroxy-N-(3-oxo-3-pyrrolidin-1-ylpropyl)pyrazole-3-carboxamide?
The InChIKey is CHGAGVZPTRHACB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19FN4O3/c18-12-5-1-2-6-13(12)22-11-14(23)16(20-22)17(25)19-8-7-15(24)21-9-3-4-10-21/h1-2,5-6,11,23H,3-4,7-10H2,(H,19,25).
What are the key properties of 1-(2-fluorophenyl)-4-hydroxy-N-(3-oxo-3-pyrrolidin-1-ylpropyl)pyrazole-3-carboxamide?
1-(2-fluorophenyl)-4-hydroxy-N-(3-oxo-3-pyrrolidin-1-ylpropyl)pyrazole-3-carboxamide has a molecular weight of 346.36 g/mol, XLogP of 1.46, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-fluorophenyl)-4-hydroxy-N-(3-oxo-3-pyrrolidin-1-ylpropyl)pyrazole-3-carboxamide is sourced from PubChem (CID 71933321), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).