3-(6-fluoro-2-oxo-3,4-dihydroquinolin-1-yl)-N-(1-hydroxypentan-3-yl)propanamide

C17H23FN2O3 — CID 109478942

IUPAC3-(6-fluoro-2-oxo-3,4-dihydroquinolin-1-yl)-N-(1-hydroxypentan-3-yl)propanamide
SMILESCCC(CCO)NC(=O)CCN1C(=O)CCc2cc(F)ccc21
InChIInChI=1S/C17H23FN2O3/c1-2-14(8-10-21)19-16(22)7-9-20-15-5-4-13(18)11-12(15)3-6-17(20)23/h4-5,11,14,21H,2-3,6-10H2,1H3,(H,19,22)
InChIKeyBCNRMKZMIWONRD-UHFFFAOYSA-N
MW322.38 g/mol
LogP1.77
Rot. Bonds7

About 3-(6-fluoro-2-oxo-3,4-dihydroquinolin-1-yl)-N-(1-hydroxypentan-3-yl)propanamide

3-(6-fluoro-2-oxo-3,4-dihydroquinolin-1-yl)-N-(1-hydroxypentan-3-yl)propanamide (PubChem CID 109478942) has the molecular formula C17H23FN2O3 and a molecular weight of 322.38 g/mol. Its IUPAC name is 3-(6-fluoro-2-oxo-3,4-dihydroquinolin-1-yl)-N-(1-hydroxypentan-3-yl)propanamide.

Molecular Properties

Compound Name3-(6-fluoro-2-oxo-3,4-dihydroquinolin-1-yl)-N-(1-hydroxypentan-3-yl)propanamide
PubChem CID109478942
Molecular FormulaC17H23FN2O3
Molecular Weight322.38 g/mol
Exact Mass322.17
IUPAC Name3-(6-fluoro-2-oxo-3,4-dihydroquinolin-1-yl)-N-(1-hydroxypentan-3-yl)propanamide
SMILESCCC(CCO)NC(=O)CCN1C(=O)CCc2cc(F)ccc21
InChIInChI=1S/C17H23FN2O3/c1-2-14(8-10-21)19-16(22)7-9-20-15-5-4-13(18)11-12(15)3-6-17(20)23/h4-5,11,14,21H,2-3,6-10H2,1H3,(H,19,22)
InChIKeyBCNRMKZMIWONRD-UHFFFAOYSA-N
XLogP1.77
TPSA69.64 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.38
LogP ≤ 51.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 3-(6-fluoro-2-oxo-3,4-dihydroquinolin-1-yl)-N-(1-hydroxypentan-3-yl)propanamide 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 3-(6-fluoro-2-oxo-3,4-dihydroquinolin-1-yl)-N-(1-hydroxypentan-3-yl)propanamide?
The IUPAC name of 3-(6-fluoro-2-oxo-3,4-dihydroquinolin-1-yl)-N-(1-hydroxypentan-3-yl)propanamide (CID 109478942) is 3-(6-fluoro-2-oxo-3,4-dihydroquinolin-1-yl)-N-(1-hydroxypentan-3-yl)propanamide.
What is the SMILES notation for 3-(6-fluoro-2-oxo-3,4-dihydroquinolin-1-yl)-N-(1-hydroxypentan-3-yl)propanamide?
The canonical SMILES for 3-(6-fluoro-2-oxo-3,4-dihydroquinolin-1-yl)-N-(1-hydroxypentan-3-yl)propanamide is CCC(CCO)NC(=O)CCN1C(=O)CCc2cc(F)ccc21.
What is the InChIKey of 3-(6-fluoro-2-oxo-3,4-dihydroquinolin-1-yl)-N-(1-hydroxypentan-3-yl)propanamide?
The InChIKey is BCNRMKZMIWONRD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23FN2O3/c1-2-14(8-10-21)19-16(22)7-9-20-15-5-4-13(18)11-12(15)3-6-17(20)23/h4-5,11,14,21H,2-3,6-10H2,1H3,(H,19,22).
What are the key properties of 3-(6-fluoro-2-oxo-3,4-dihydroquinolin-1-yl)-N-(1-hydroxypentan-3-yl)propanamide?
3-(6-fluoro-2-oxo-3,4-dihydroquinolin-1-yl)-N-(1-hydroxypentan-3-yl)propanamide has a molecular weight of 322.38 g/mol, XLogP of 1.77, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(6-fluoro-2-oxo-3,4-dihydroquinolin-1-yl)-N-(1-hydroxypentan-3-yl)propanamide is sourced from PubChem (CID 109478942), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).