3-[4-(trifluoromethyl)phenyl]indol-2-one

C15H8F3NO — CID 142783918

IUPAC3-[4-(trifluoromethyl)phenyl]indol-2-one
SMILESO=C1N=c2ccccc2=C1c1ccc(C(F)(F)F)cc1
InChIInChI=1S/C15H8F3NO/c16-15(17,18)10-7-5-9(6-8-10)13-11-3-1-2-4-12(11)19-14(13)20/h1-8H
InChIKeyOYDFCDZJXOUNSX-UHFFFAOYSA-N
MW275.23 g/mol
LogP2.06
Rot. Bonds1

About 3-[4-(trifluoromethyl)phenyl]indol-2-one

3-[4-(trifluoromethyl)phenyl]indol-2-one (PubChem CID 142783918) has the molecular formula C15H8F3NO and a molecular weight of 275.23 g/mol. Its IUPAC name is 3-[4-(trifluoromethyl)phenyl]indol-2-one.

Molecular Properties

Compound Name3-[4-(trifluoromethyl)phenyl]indol-2-one
PubChem CID142783918
Molecular FormulaC15H8F3NO
Molecular Weight275.23 g/mol
Exact Mass275.06
IUPAC Name3-[4-(trifluoromethyl)phenyl]indol-2-one
SMILESO=C1N=c2ccccc2=C1c1ccc(C(F)(F)F)cc1
InChIInChI=1S/C15H8F3NO/c16-15(17,18)10-7-5-9(6-8-10)13-11-3-1-2-4-12(11)19-14(13)20/h1-8H
InChIKeyOYDFCDZJXOUNSX-UHFFFAOYSA-N
XLogP2.06
TPSA29.43 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.23
LogP ≤ 52.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

3-[4-(trifluoromethyl)phenyl]isoindol-1-one
CID 155385074
3-(4-methylphenyl)-4-[4-[2-[4-[3-oxo-2,4-diphenyl-5-[4-(trifluoromethyl)phenyl]cyclopenta-1,4-dien-1-yl]phenyl]ethynyl]phenyl]-2,5-diphenylcyclopenta-2,4-dien-1-one
CID 123533466
3-[4-(trifluoromethyl)phenyl]-4H-isoquinolin-1-one
CID 69179510
3-(4-methylphenyl)-4-[4-(trifluoromethyl)phenyl]-2H-furan-5-one
CID 162617833
1-methyl-4-(trifluoromethyl)benzene;toluene
CID 159876070
1-methyl-4-[4-[4-[4-(trifluoromethyl)phenyl]phenyl]phenyl]benzene
CID 59630308
2,3,6-triphenyl-4,5-bis[4-(trifluoromethyl)phenyl]pyridine
CID 102130644
6-hydroxy-5-(2-oxoindol-3-yl)-1H-pyrimidine-2,4-dione;hydrate
CID 135891515
2-[4-(trifluoromethyl)phenyl]-[1]benzofuro[3,2-d][1,3]oxazin-4-one
CID 3983355
4-phenyl-5-(trifluoromethyl)pyrazol-3-one
CID 162536123
2-[4-(trifluoromethyl)phenyl]pyrimidine
CID 15486309
1-nitro-2-[4-(trifluoromethyl)phenyl]benzene
CID 22625277

Frequently Asked Questions

What is the IUPAC name of 3-[4-(trifluoromethyl)phenyl]indol-2-one?
The IUPAC name of 3-[4-(trifluoromethyl)phenyl]indol-2-one (CID 142783918) is 3-[4-(trifluoromethyl)phenyl]indol-2-one.
What is the SMILES notation for 3-[4-(trifluoromethyl)phenyl]indol-2-one?
The canonical SMILES for 3-[4-(trifluoromethyl)phenyl]indol-2-one is O=C1N=c2ccccc2=C1c1ccc(C(F)(F)F)cc1.
What is the InChIKey of 3-[4-(trifluoromethyl)phenyl]indol-2-one?
The InChIKey is OYDFCDZJXOUNSX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H8F3NO/c16-15(17,18)10-7-5-9(6-8-10)13-11-3-1-2-4-12(11)19-14(13)20/h1-8H.
What are the key properties of 3-[4-(trifluoromethyl)phenyl]indol-2-one?
3-[4-(trifluoromethyl)phenyl]indol-2-one has a molecular weight of 275.23 g/mol, XLogP of 2.06, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[4-(trifluoromethyl)phenyl]indol-2-one is sourced from PubChem (CID 142783918), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).