7,8-difluoro-2-phenyl-1H-quinolin-4-one

C15H9F2NO — CID 61076472

IUPAC7,8-difluoro-2-phenyl-1H-quinolin-4-one
SMILESO=c1cc(-c2ccccc2)[nH]c2c(F)c(F)ccc12
InChIInChI=1S/C15H9F2NO/c16-11-7-6-10-13(19)8-12(18-15(10)14(11)17)9-4-2-1-3-5-9/h1-8H,(H,18,19)
InChIKeyPBQCCPJVGUTFJU-UHFFFAOYSA-N
MW257.24 g/mol
LogP3.47
Rot. Bonds1

About 7,8-difluoro-2-phenyl-1H-quinolin-4-one

7,8-difluoro-2-phenyl-1H-quinolin-4-one (PubChem CID 61076472) has the molecular formula C15H9F2NO and a molecular weight of 257.24 g/mol. Its IUPAC name is 7,8-difluoro-2-phenyl-1H-quinolin-4-one.

Molecular Properties

Compound Name7,8-difluoro-2-phenyl-1H-quinolin-4-one
PubChem CID61076472
Molecular FormulaC15H9F2NO
Molecular Weight257.24 g/mol
Exact Mass257.07
IUPAC Name7,8-difluoro-2-phenyl-1H-quinolin-4-one
SMILESO=c1cc(-c2ccccc2)[nH]c2c(F)c(F)ccc12
InChIInChI=1S/C15H9F2NO/c16-11-7-6-10-13(19)8-12(18-15(10)14(11)17)9-4-2-1-3-5-9/h1-8H,(H,18,19)
InChIKeyPBQCCPJVGUTFJU-UHFFFAOYSA-N
XLogP3.47
TPSA32.86 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.24
LogP ≤ 53.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

7-bromo-8-fluoro-2-phenyl-1H-quinolin-4-one
CID 169130419
6,8-difluoro-2-phenyl-1H-quinolin-4-one
CID 43668321
6-bromo-8-fluoro-2-phenyl-1H-quinolin-4-one
CID 43668193
5,6,8-trifluoro-2-phenyl-1H-quinolin-4-one
CID 62810761
7,8-dimethoxy-2-phenyl-1H-quinolin-4-one
CID 11300504
8-fluoro-2-(4-hydroxyphenyl)-1H-quinolin-4-one
CID 66650720
ethyl N-[2-(7,8-difluoro-4-oxo-1H-quinolin-2-yl)phenyl]carbamate
CID 123863775
4,9-diphenyl-3,10-diazatetracyclo[10.4.0.02,6.07,11]hexadeca-1(16),2(6),4,7(11),8,12,14-heptaene
CID 164666039
ethyl N-[2-(7,8-difluoro-4-oxo-1H-quinolin-2-yl)-5-hydroxyphenyl]carbamate
CID 66650249
5,7-dihydroxy-8-methoxy-2-phenyl-1H-quinolin-4-one
CID 141354542
5-bromo-8-chloro-2-phenyl-1H-quinolin-4-one
CID 62909253
2,6-diphenyl-7H-pyrazolo[3,4-b]pyridin-4-one
CID 135705355

Frequently Asked Questions

What is the IUPAC name of 7,8-difluoro-2-phenyl-1H-quinolin-4-one?
The IUPAC name of 7,8-difluoro-2-phenyl-1H-quinolin-4-one (CID 61076472) is 7,8-difluoro-2-phenyl-1H-quinolin-4-one.
What is the SMILES notation for 7,8-difluoro-2-phenyl-1H-quinolin-4-one?
The canonical SMILES for 7,8-difluoro-2-phenyl-1H-quinolin-4-one is O=c1cc(-c2ccccc2)[nH]c2c(F)c(F)ccc12.
What is the InChIKey of 7,8-difluoro-2-phenyl-1H-quinolin-4-one?
The InChIKey is PBQCCPJVGUTFJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H9F2NO/c16-11-7-6-10-13(19)8-12(18-15(10)14(11)17)9-4-2-1-3-5-9/h1-8H,(H,18,19).
What are the key properties of 7,8-difluoro-2-phenyl-1H-quinolin-4-one?
7,8-difluoro-2-phenyl-1H-quinolin-4-one has a molecular weight of 257.24 g/mol, XLogP of 3.47, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 7,8-difluoro-2-phenyl-1H-quinolin-4-one is sourced from PubChem (CID 61076472), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).