4-[(4-fluorophenyl)methoxy]-3-[(4-fluorophenyl)methyl]-1H-quinolin-2-one

C23H17F2NO2 — CID 11948205

IUPAC4-[(4-fluorophenyl)methoxy]-3-[(4-fluorophenyl)methyl]-1H-quinolin-2-one
SMILESO=c1[nH]c2ccccc2c(OCc2ccc(F)cc2)c1Cc1ccc(F)cc1
InChIInChI=1S/C23H17F2NO2/c24-17-9-5-15(6-10-17)13-20-22(28-14-16-7-11-18(25)12-8-16)19-3-1-2-4-21(19)26-23(20)27/h1-12H,13-14H2,(H,26,27)
InChIKeyLAKXWNPHPLVZMI-UHFFFAOYSA-N
MW377.39 g/mol
LogP4.98
Rot. Bonds5

About 4-[(4-fluorophenyl)methoxy]-3-[(4-fluorophenyl)methyl]-1H-quinolin-2-one

4-[(4-fluorophenyl)methoxy]-3-[(4-fluorophenyl)methyl]-1H-quinolin-2-one (PubChem CID 11948205) has the molecular formula C23H17F2NO2 and a molecular weight of 377.39 g/mol. Its IUPAC name is 4-[(4-fluorophenyl)methoxy]-3-[(4-fluorophenyl)methyl]-1H-quinolin-2-one.

Molecular Properties

Compound Name4-[(4-fluorophenyl)methoxy]-3-[(4-fluorophenyl)methyl]-1H-quinolin-2-one
PubChem CID11948205
Molecular FormulaC23H17F2NO2
Molecular Weight377.39 g/mol
Exact Mass377.12
IUPAC Name4-[(4-fluorophenyl)methoxy]-3-[(4-fluorophenyl)methyl]-1H-quinolin-2-one
SMILESO=c1[nH]c2ccccc2c(OCc2ccc(F)cc2)c1Cc1ccc(F)cc1
InChIInChI=1S/C23H17F2NO2/c24-17-9-5-15(6-10-17)13-20-22(28-14-16-7-11-18(25)12-8-16)19-3-1-2-4-21(19)26-23(20)27/h1-12H,13-14H2,(H,26,27)
InChIKeyLAKXWNPHPLVZMI-UHFFFAOYSA-N
XLogP4.98
TPSA42.09 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500377.39
LogP ≤ 54.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-[(4-fluorophenyl)methoxy]-3-[(4-fluorophenyl)methyl]-1H-quinolin-2-one?
The IUPAC name of 4-[(4-fluorophenyl)methoxy]-3-[(4-fluorophenyl)methyl]-1H-quinolin-2-one (CID 11948205) is 4-[(4-fluorophenyl)methoxy]-3-[(4-fluorophenyl)methyl]-1H-quinolin-2-one.
What is the SMILES notation for 4-[(4-fluorophenyl)methoxy]-3-[(4-fluorophenyl)methyl]-1H-quinolin-2-one?
The canonical SMILES for 4-[(4-fluorophenyl)methoxy]-3-[(4-fluorophenyl)methyl]-1H-quinolin-2-one is O=c1[nH]c2ccccc2c(OCc2ccc(F)cc2)c1Cc1ccc(F)cc1.
What is the InChIKey of 4-[(4-fluorophenyl)methoxy]-3-[(4-fluorophenyl)methyl]-1H-quinolin-2-one?
The InChIKey is LAKXWNPHPLVZMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H17F2NO2/c24-17-9-5-15(6-10-17)13-20-22(28-14-16-7-11-18(25)12-8-16)19-3-1-2-4-21(19)26-23(20)27/h1-12H,13-14H2,(H,26,27).
What are the key properties of 4-[(4-fluorophenyl)methoxy]-3-[(4-fluorophenyl)methyl]-1H-quinolin-2-one?
4-[(4-fluorophenyl)methoxy]-3-[(4-fluorophenyl)methyl]-1H-quinolin-2-one has a molecular weight of 377.39 g/mol, XLogP of 4.98, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(4-fluorophenyl)methoxy]-3-[(4-fluorophenyl)methyl]-1H-quinolin-2-one is sourced from PubChem (CID 11948205), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).