6-[2-(5-fluoro-2-morpholin-4-ylphenyl)-2-oxoethyl]-4-methyl-1H-quinolin-2-one

C22H21FN2O3 — CID 159564619

IUPAC6-[2-(5-fluoro-2-morpholin-4-ylphenyl)-2-oxoethyl]-4-methyl-1H-quinolin-2-one
SMILESCc1cc(=O)[nH]c2ccc(CC(=O)c3cc(F)ccc3N3CCOCC3)cc12
InChIInChI=1S/C22H21FN2O3/c1-14-10-22(27)24-19-4-2-15(11-17(14)19)12-21(26)18-13-16(23)3-5-20(18)25-6-8-28-9-7-25/h2-5,10-11,13H,6-9,12H2,1H3,(H,24,27)
InChIKeyCDPAOQWIFRSJOR-UHFFFAOYSA-N
MW380.42 g/mol
LogP3.24
Rot. Bonds4

About 6-[2-(5-fluoro-2-morpholin-4-ylphenyl)-2-oxoethyl]-4-methyl-1H-quinolin-2-one

6-[2-(5-fluoro-2-morpholin-4-ylphenyl)-2-oxoethyl]-4-methyl-1H-quinolin-2-one (PubChem CID 159564619) has the molecular formula C22H21FN2O3 and a molecular weight of 380.42 g/mol. Its IUPAC name is 6-[2-(5-fluoro-2-morpholin-4-ylphenyl)-2-oxoethyl]-4-methyl-1H-quinolin-2-one.

Molecular Properties

Compound Name6-[2-(5-fluoro-2-morpholin-4-ylphenyl)-2-oxoethyl]-4-methyl-1H-quinolin-2-one
PubChem CID159564619
Molecular FormulaC22H21FN2O3
Molecular Weight380.42 g/mol
Exact Mass380.15
IUPAC Name6-[2-(5-fluoro-2-morpholin-4-ylphenyl)-2-oxoethyl]-4-methyl-1H-quinolin-2-one
SMILESCc1cc(=O)[nH]c2ccc(CC(=O)c3cc(F)ccc3N3CCOCC3)cc12
InChIInChI=1S/C22H21FN2O3/c1-14-10-22(27)24-19-4-2-15(11-17(14)19)12-21(26)18-13-16(23)3-5-20(18)25-6-8-28-9-7-25/h2-5,10-11,13H,6-9,12H2,1H3,(H,24,27)
InChIKeyCDPAOQWIFRSJOR-UHFFFAOYSA-N
XLogP3.24
TPSA62.40 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.42
LogP ≤ 53.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 6-[2-(5-fluoro-2-morpholin-4-ylphenyl)-2-oxoethyl]-4-methyl-1H-quinolin-2-one with MolForge

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Related Compounds

ethyl 5-[2-(2-fluorophenyl)-2-oxoethyl]-2-morpholin-4-ylbenzoate
CID 146955630
N-(4-methyl-2-oxo-1H-quinolin-6-yl)-2-morpholin-4-yl-5-sulfamoylbenzamide
CID 118695192
ethane;6-methyl-4-morpholin-4-yl-1H-quinolin-2-one
CID 145235325
methyl 5-[(4-fluorophenyl)methylamino]-2-morpholin-4-ylbenzoate
CID 2997066
2-(2,3-dimethyl-1H-indol-5-yl)-1-(4,6-dimorpholin-4-yl-2-pyridinyl)ethanone
CID 58060148
5-[[2-hydroxyethyl(methyl)amino]methyl]-N-(4-methyl-2-oxo-1H-quinolin-6-yl)-2-pyrrolidin-1-ylbenzamide
CID 118695250
1-(3-fluoro-4-morpholin-4-ylphenyl)butan-1-one
CID 723653
5-fluoro-3-methyl-N-(2-morpholin-4-ylphenyl)-1H-indole-2-carboxamide
CID 113204648
N-(4-methyl-2-oxo-1H-quinolin-6-yl)-5-(4-methylpentyl)-2-pyrrolidin-1-ylbenzamide
CID 157255920
[2-[(4-fluorophenyl)methylamino]-2-oxoethyl] 2-morpholin-4-yl-5-nitrobenzoate
CID 16542086
2-(3,4-dichlorophenyl)-1-(5-fluoro-2-methylphenyl)ethanone
CID 63409531
N-(5-fluoro-2-morpholin-4-ylphenyl)-2-methylbenzamide
CID 113092681

Frequently Asked Questions

What is the IUPAC name of 6-[2-(5-fluoro-2-morpholin-4-ylphenyl)-2-oxoethyl]-4-methyl-1H-quinolin-2-one?
The IUPAC name of 6-[2-(5-fluoro-2-morpholin-4-ylphenyl)-2-oxoethyl]-4-methyl-1H-quinolin-2-one (CID 159564619) is 6-[2-(5-fluoro-2-morpholin-4-ylphenyl)-2-oxoethyl]-4-methyl-1H-quinolin-2-one.
What is the SMILES notation for 6-[2-(5-fluoro-2-morpholin-4-ylphenyl)-2-oxoethyl]-4-methyl-1H-quinolin-2-one?
The canonical SMILES for 6-[2-(5-fluoro-2-morpholin-4-ylphenyl)-2-oxoethyl]-4-methyl-1H-quinolin-2-one is Cc1cc(=O)[nH]c2ccc(CC(=O)c3cc(F)ccc3N3CCOCC3)cc12.
What is the InChIKey of 6-[2-(5-fluoro-2-morpholin-4-ylphenyl)-2-oxoethyl]-4-methyl-1H-quinolin-2-one?
The InChIKey is CDPAOQWIFRSJOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H21FN2O3/c1-14-10-22(27)24-19-4-2-15(11-17(14)19)12-21(26)18-13-16(23)3-5-20(18)25-6-8-28-9-7-25/h2-5,10-11,13H,6-9,12H2,1H3,(H,24,27).
What are the key properties of 6-[2-(5-fluoro-2-morpholin-4-ylphenyl)-2-oxoethyl]-4-methyl-1H-quinolin-2-one?
6-[2-(5-fluoro-2-morpholin-4-ylphenyl)-2-oxoethyl]-4-methyl-1H-quinolin-2-one has a molecular weight of 380.42 g/mol, XLogP of 3.24, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[2-(5-fluoro-2-morpholin-4-ylphenyl)-2-oxoethyl]-4-methyl-1H-quinolin-2-one is sourced from PubChem (CID 159564619), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).