5-(3-fluorophenyl)-3-hydroxy-N-[2-oxo-2-(propylamino)ethyl]pyridine-2-carboxamide

C17H18FN3O3 — CID 71086627

IUPAC5-(3-fluorophenyl)-3-hydroxy-N-[2-oxo-2-(propylamino)ethyl]pyridine-2-carboxamide
SMILESCCCNC(=O)CNC(=O)c1ncc(-c2cccc(F)c2)cc1O
InChIInChI=1S/C17H18FN3O3/c1-2-6-19-15(23)10-21-17(24)16-14(22)8-12(9-20-16)11-4-3-5-13(18)7-11/h3-5,7-9,22H,2,6,10H2,1H3,(H,19,23)(H,21,24)
InChIKeyQKGPEBANCONHBI-UHFFFAOYSA-N
MW331.35 g/mol
LogP1.85
Rot. Bonds6

About 5-(3-fluorophenyl)-3-hydroxy-N-[2-oxo-2-(propylamino)ethyl]pyridine-2-carboxamide

5-(3-fluorophenyl)-3-hydroxy-N-[2-oxo-2-(propylamino)ethyl]pyridine-2-carboxamide (PubChem CID 71086627) has the molecular formula C17H18FN3O3 and a molecular weight of 331.35 g/mol. Its IUPAC name is 5-(3-fluorophenyl)-3-hydroxy-N-[2-oxo-2-(propylamino)ethyl]pyridine-2-carboxamide.

Molecular Properties

Compound Name5-(3-fluorophenyl)-3-hydroxy-N-[2-oxo-2-(propylamino)ethyl]pyridine-2-carboxamide
PubChem CID71086627
Molecular FormulaC17H18FN3O3
Molecular Weight331.35 g/mol
Exact Mass331.13
IUPAC Name5-(3-fluorophenyl)-3-hydroxy-N-[2-oxo-2-(propylamino)ethyl]pyridine-2-carboxamide
SMILESCCCNC(=O)CNC(=O)c1ncc(-c2cccc(F)c2)cc1O
InChIInChI=1S/C17H18FN3O3/c1-2-6-19-15(23)10-21-17(24)16-14(22)8-12(9-20-16)11-4-3-5-13(18)7-11/h3-5,7-9,22H,2,6,10H2,1H3,(H,19,23)(H,21,24)
InChIKeyQKGPEBANCONHBI-UHFFFAOYSA-N
XLogP1.85
TPSA91.32 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.35
LogP ≤ 51.85
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze 5-(3-fluorophenyl)-3-hydroxy-N-[2-oxo-2-(propylamino)ethyl]pyridine-2-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 5-(3-fluorophenyl)-3-hydroxy-N-[2-oxo-2-(propylamino)ethyl]pyridine-2-carboxamide?
The IUPAC name of 5-(3-fluorophenyl)-3-hydroxy-N-[2-oxo-2-(propylamino)ethyl]pyridine-2-carboxamide (CID 71086627) is 5-(3-fluorophenyl)-3-hydroxy-N-[2-oxo-2-(propylamino)ethyl]pyridine-2-carboxamide.
What is the SMILES notation for 5-(3-fluorophenyl)-3-hydroxy-N-[2-oxo-2-(propylamino)ethyl]pyridine-2-carboxamide?
The canonical SMILES for 5-(3-fluorophenyl)-3-hydroxy-N-[2-oxo-2-(propylamino)ethyl]pyridine-2-carboxamide is CCCNC(=O)CNC(=O)c1ncc(-c2cccc(F)c2)cc1O.
What is the InChIKey of 5-(3-fluorophenyl)-3-hydroxy-N-[2-oxo-2-(propylamino)ethyl]pyridine-2-carboxamide?
The InChIKey is QKGPEBANCONHBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18FN3O3/c1-2-6-19-15(23)10-21-17(24)16-14(22)8-12(9-20-16)11-4-3-5-13(18)7-11/h3-5,7-9,22H,2,6,10H2,1H3,(H,19,23)(H,21,24).
What are the key properties of 5-(3-fluorophenyl)-3-hydroxy-N-[2-oxo-2-(propylamino)ethyl]pyridine-2-carboxamide?
5-(3-fluorophenyl)-3-hydroxy-N-[2-oxo-2-(propylamino)ethyl]pyridine-2-carboxamide has a molecular weight of 331.35 g/mol, XLogP of 1.85, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(3-fluorophenyl)-3-hydroxy-N-[2-oxo-2-(propylamino)ethyl]pyridine-2-carboxamide is sourced from PubChem (CID 71086627), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).