7-fluoro-4-(8-hydroxy-3,4-dihydro-2H-quinoline-1-carbonyl)-3,4-dihydro-1H-quinolin-2-one

C19H17FN2O3 — CID 138996765

IUPAC7-fluoro-4-(8-hydroxy-3,4-dihydro-2H-quinoline-1-carbonyl)-3,4-dihydro-1H-quinolin-2-one
SMILESO=C1CC(C(=O)N2CCCc3cccc(O)c32)c2ccc(F)cc2N1
InChIInChI=1S/C19H17FN2O3/c20-12-6-7-13-14(10-17(24)21-15(13)9-12)19(25)22-8-2-4-11-3-1-5-16(23)18(11)22/h1,3,5-7,9,14,23H,2,4,8,10H2,(H,21,24)
InChIKeyAILRQIFZMHSNAU-UHFFFAOYSA-N
MW340.35 g/mol
LogP2.94
Rot. Bonds1

About 7-fluoro-4-(8-hydroxy-3,4-dihydro-2H-quinoline-1-carbonyl)-3,4-dihydro-1H-quinolin-2-one

7-fluoro-4-(8-hydroxy-3,4-dihydro-2H-quinoline-1-carbonyl)-3,4-dihydro-1H-quinolin-2-one (PubChem CID 138996765) has the molecular formula C19H17FN2O3 and a molecular weight of 340.35 g/mol. Its IUPAC name is 7-fluoro-4-(8-hydroxy-3,4-dihydro-2H-quinoline-1-carbonyl)-3,4-dihydro-1H-quinolin-2-one.

Molecular Properties

Compound Name7-fluoro-4-(8-hydroxy-3,4-dihydro-2H-quinoline-1-carbonyl)-3,4-dihydro-1H-quinolin-2-one
PubChem CID138996765
Molecular FormulaC19H17FN2O3
Molecular Weight340.35 g/mol
Exact Mass340.12
IUPAC Name7-fluoro-4-(8-hydroxy-3,4-dihydro-2H-quinoline-1-carbonyl)-3,4-dihydro-1H-quinolin-2-one
SMILESO=C1CC(C(=O)N2CCCc3cccc(O)c32)c2ccc(F)cc2N1
InChIInChI=1S/C19H17FN2O3/c20-12-6-7-13-14(10-17(24)21-15(13)9-12)19(25)22-8-2-4-11-3-1-5-16(23)18(11)22/h1,3,5-7,9,14,23H,2,4,8,10H2,(H,21,24)
InChIKeyAILRQIFZMHSNAU-UHFFFAOYSA-N
XLogP2.94
TPSA69.64 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.35
LogP ≤ 52.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 7-fluoro-4-(8-hydroxy-3,4-dihydro-2H-quinoline-1-carbonyl)-3,4-dihydro-1H-quinolin-2-one with MolForge

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Launch Full Analysis

Related Compounds

7-fluoro-4-(4-hydroxypiperidine-1-carbonyl)-3,4-dihydro-1H-quinolin-2-one
CID 78843557
(4R)-4-(2,3-dihydro-1,4-benzoxazine-4-carbonyl)-7-fluoro-3,4-dihydro-1H-quinolin-2-one
CID 94023528
(4S)-4-[(4aS,8aS)-3,4,4a,5,6,7,8,8a-octahydro-2H-quinoline-1-carbonyl]-7-fluoro-3,4-dihydro-1H-quinolin-2-one
CID 51647202
(3S)-2-[(4S)-7-fluoro-2-oxo-3,4-dihydro-1H-quinoline-4-carbonyl]-3,4-dihydro-1H-isoquinoline-3-carboxylic acid
CID 125132896
7-fluoro-4-[4-(2,2,2-trifluoroethyl)-1,4-diazepane-1-carbonyl]-3,4-dihydro-1H-quinolin-2-one
CID 78870079
(4R)-4-(4-benzoylpiperidine-1-carbonyl)-7-fluoro-3,4-dihydro-1H-quinolin-2-one
CID 41310381
7-fluoro-4-[4-(1-hydroxyethyl)piperidine-1-carbonyl]-3,4-dihydro-1H-quinolin-2-one
CID 111434115
7-fluoro-4-[2-(methylaminomethyl)pyrrolidine-1-carbonyl]-3,4-dihydro-1H-quinolin-2-one
CID 119649615
7-fluoro-2-oxo-N-[2-(2-oxopyrrolidin-1-yl)phenyl]-3,4-dihydro-1H-quinoline-4-carboxamide
CID 42934604
(4-fluoro-2-methylphenyl)-(8-hydroxy-3,4-dihydro-2H-quinolin-1-yl)methanone
CID 115970106
N-(2,3-dihydro-1H-inden-1-yl)-7-fluoro-2-oxo-3,4-dihydro-1H-quinoline-4-carboxamide
CID 18143184
4-[2-(1-aminoethyl)piperidine-1-carbonyl]-7-fluoro-3,4-dihydro-1H-quinolin-2-one
CID 119435412

Frequently Asked Questions

What is the IUPAC name of 7-fluoro-4-(8-hydroxy-3,4-dihydro-2H-quinoline-1-carbonyl)-3,4-dihydro-1H-quinolin-2-one?
The IUPAC name of 7-fluoro-4-(8-hydroxy-3,4-dihydro-2H-quinoline-1-carbonyl)-3,4-dihydro-1H-quinolin-2-one (CID 138996765) is 7-fluoro-4-(8-hydroxy-3,4-dihydro-2H-quinoline-1-carbonyl)-3,4-dihydro-1H-quinolin-2-one.
What is the SMILES notation for 7-fluoro-4-(8-hydroxy-3,4-dihydro-2H-quinoline-1-carbonyl)-3,4-dihydro-1H-quinolin-2-one?
The canonical SMILES for 7-fluoro-4-(8-hydroxy-3,4-dihydro-2H-quinoline-1-carbonyl)-3,4-dihydro-1H-quinolin-2-one is O=C1CC(C(=O)N2CCCc3cccc(O)c32)c2ccc(F)cc2N1.
What is the InChIKey of 7-fluoro-4-(8-hydroxy-3,4-dihydro-2H-quinoline-1-carbonyl)-3,4-dihydro-1H-quinolin-2-one?
The InChIKey is AILRQIFZMHSNAU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17FN2O3/c20-12-6-7-13-14(10-17(24)21-15(13)9-12)19(25)22-8-2-4-11-3-1-5-16(23)18(11)22/h1,3,5-7,9,14,23H,2,4,8,10H2,(H,21,24).
What are the key properties of 7-fluoro-4-(8-hydroxy-3,4-dihydro-2H-quinoline-1-carbonyl)-3,4-dihydro-1H-quinolin-2-one?
7-fluoro-4-(8-hydroxy-3,4-dihydro-2H-quinoline-1-carbonyl)-3,4-dihydro-1H-quinolin-2-one has a molecular weight of 340.35 g/mol, XLogP of 2.94, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-fluoro-4-(8-hydroxy-3,4-dihydro-2H-quinoline-1-carbonyl)-3,4-dihydro-1H-quinolin-2-one is sourced from PubChem (CID 138996765), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).