7-(4-fluoro-2-methylphenyl)-1-(2-morpholin-4-ylethyl)-3,4-dihydroquinolin-2-one

C22H25FN2O2 — CID 175346372

IUPAC7-(4-fluoro-2-methylphenyl)-1-(2-morpholin-4-ylethyl)-3,4-dihydroquinolin-2-one
SMILESCc1cc(F)ccc1-c1ccc2c(c1)N(CCN1CCOCC1)C(=O)CC2
InChIInChI=1S/C22H25FN2O2/c1-16-14-19(23)5-6-20(16)18-3-2-17-4-7-22(26)25(21(17)15-18)9-8-24-10-12-27-13-11-24/h2-3,5-6,14-15H,4,7-13H2,1H3
InChIKeyGGZRKCKFYPXHSV-UHFFFAOYSA-N
MW368.45 g/mol
LogP3.41
Rot. Bonds4

About 7-(4-fluoro-2-methylphenyl)-1-(2-morpholin-4-ylethyl)-3,4-dihydroquinolin-2-one

7-(4-fluoro-2-methylphenyl)-1-(2-morpholin-4-ylethyl)-3,4-dihydroquinolin-2-one (PubChem CID 175346372) has the molecular formula C22H25FN2O2 and a molecular weight of 368.45 g/mol. Its IUPAC name is 7-(4-fluoro-2-methylphenyl)-1-(2-morpholin-4-ylethyl)-3,4-dihydroquinolin-2-one.

Molecular Properties

Compound Name7-(4-fluoro-2-methylphenyl)-1-(2-morpholin-4-ylethyl)-3,4-dihydroquinolin-2-one
PubChem CID175346372
Molecular FormulaC22H25FN2O2
Molecular Weight368.45 g/mol
Exact Mass368.19
IUPAC Name7-(4-fluoro-2-methylphenyl)-1-(2-morpholin-4-ylethyl)-3,4-dihydroquinolin-2-one
SMILESCc1cc(F)ccc1-c1ccc2c(c1)N(CCN1CCOCC1)C(=O)CC2
InChIInChI=1S/C22H25FN2O2/c1-16-14-19(23)5-6-20(16)18-3-2-17-4-7-22(26)25(21(17)15-18)9-8-24-10-12-27-13-11-24/h2-3,5-6,14-15H,4,7-13H2,1H3
InChIKeyGGZRKCKFYPXHSV-UHFFFAOYSA-N
XLogP3.41
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.45
LogP ≤ 53.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

7-(4-fluorophenyl)-1-(2-morpholin-4-ylethyl)-3,4-dihydroquinolin-2-one
CID 175346345
1-(2-morpholin-4-ylethyl)-7-(3-phenylphenyl)-3,4-dihydroquinolin-2-one
CID 175346344
1-[2-(azetidin-1-yl)ethyl]-6-(4-fluoro-2-methylphenyl)-3H-pyrrolo[3,2-b]pyridin-2-one
CID 159561117
7-fluoro-1-(3-hydroxybutyl)-3,4-dihydroquinolin-2-one
CID 113399039
3-(7-fluoro-2-oxo-3,4-dihydroquinolin-1-yl)propanal
CID 63041512
7-fluoro-1-[2-(propylamino)ethyl]-3,4-dihydroquinolin-2-one
CID 61387630
4-(7-fluoro-2-oxo-3,4-dihydroquinolin-1-yl)butanenitrile
CID 43243930
7-methoxy-1-(2-piperidin-1-ylethyl)-3,4-dihydroquinolin-2-one
CID 141163160
tert-butyl 3-(7-fluoro-2-oxo-3,4-dihydroquinolin-1-yl)propanoate
CID 116662624
7-fluoro-1-[3-(propylamino)propyl]-3,4-dihydroquinolin-2-one
CID 61387656
1-(3-hydroxypropyl)-7-morpholin-4-yl-3,4-dihydroquinolin-2-one
CID 175020264
7-fluoro-1-prop-2-ynyl-3,4-dihydroquinolin-2-one
CID 61344681

Frequently Asked Questions

What is the IUPAC name of 7-(4-fluoro-2-methylphenyl)-1-(2-morpholin-4-ylethyl)-3,4-dihydroquinolin-2-one?
The IUPAC name of 7-(4-fluoro-2-methylphenyl)-1-(2-morpholin-4-ylethyl)-3,4-dihydroquinolin-2-one (CID 175346372) is 7-(4-fluoro-2-methylphenyl)-1-(2-morpholin-4-ylethyl)-3,4-dihydroquinolin-2-one.
What is the SMILES notation for 7-(4-fluoro-2-methylphenyl)-1-(2-morpholin-4-ylethyl)-3,4-dihydroquinolin-2-one?
The canonical SMILES for 7-(4-fluoro-2-methylphenyl)-1-(2-morpholin-4-ylethyl)-3,4-dihydroquinolin-2-one is Cc1cc(F)ccc1-c1ccc2c(c1)N(CCN1CCOCC1)C(=O)CC2.
What is the InChIKey of 7-(4-fluoro-2-methylphenyl)-1-(2-morpholin-4-ylethyl)-3,4-dihydroquinolin-2-one?
The InChIKey is GGZRKCKFYPXHSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H25FN2O2/c1-16-14-19(23)5-6-20(16)18-3-2-17-4-7-22(26)25(21(17)15-18)9-8-24-10-12-27-13-11-24/h2-3,5-6,14-15H,4,7-13H2,1H3.
What are the key properties of 7-(4-fluoro-2-methylphenyl)-1-(2-morpholin-4-ylethyl)-3,4-dihydroquinolin-2-one?
7-(4-fluoro-2-methylphenyl)-1-(2-morpholin-4-ylethyl)-3,4-dihydroquinolin-2-one has a molecular weight of 368.45 g/mol, XLogP of 3.41, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(4-fluoro-2-methylphenyl)-1-(2-morpholin-4-ylethyl)-3,4-dihydroquinolin-2-one is sourced from PubChem (CID 175346372), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).