5-(3,5-difluorobenzoyl)-1,3-dihydroindol-2-one

C15H9F2NO2 — CID 43338600

IUPAC5-(3,5-difluorobenzoyl)-1,3-dihydroindol-2-one
SMILESO=C1Cc2cc(C(=O)c3cc(F)cc(F)c3)ccc2N1
InChIInChI=1S/C15H9F2NO2/c16-11-4-10(5-12(17)7-11)15(20)8-1-2-13-9(3-8)6-14(19)18-13/h1-5,7H,6H2,(H,18,19)
InChIKeyUIFRNDUHUGPXGI-UHFFFAOYSA-N
MW273.24 g/mol
LogP2.69
Rot. Bonds2

About 5-(3,5-difluorobenzoyl)-1,3-dihydroindol-2-one

5-(3,5-difluorobenzoyl)-1,3-dihydroindol-2-one (PubChem CID 43338600) has the molecular formula C15H9F2NO2 and a molecular weight of 273.24 g/mol. Its IUPAC name is 5-(3,5-difluorobenzoyl)-1,3-dihydroindol-2-one.

Molecular Properties

Compound Name5-(3,5-difluorobenzoyl)-1,3-dihydroindol-2-one
PubChem CID43338600
Molecular FormulaC15H9F2NO2
Molecular Weight273.24 g/mol
Exact Mass273.06
IUPAC Name5-(3,5-difluorobenzoyl)-1,3-dihydroindol-2-one
SMILESO=C1Cc2cc(C(=O)c3cc(F)cc(F)c3)ccc2N1
InChIInChI=1S/C15H9F2NO2/c16-11-4-10(5-12(17)7-11)15(20)8-1-2-13-9(3-8)6-14(19)18-13/h1-5,7H,6H2,(H,18,19)
InChIKeyUIFRNDUHUGPXGI-UHFFFAOYSA-N
XLogP2.69
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.24
LogP ≤ 52.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-(2,2,2-trifluoroacetyl)-1,3-dihydroindol-2-one
CID 80503823
5-(4-ethylbenzoyl)-1,3-dihydroindol-2-one
CID 43338587
5-(3-bromo-5-methylbenzoyl)-1,3-dihydroindol-2-one
CID 104850942
5-(1H-pyrazole-4-carbonyl)-1,3-dihydroindol-2-one
CID 114988363
5-[2-(4-fluorophenyl)acetyl]-1,3-dihydroindol-2-one
CID 43338576
5-(2,3-dihydro-1-benzofuran-5-carbonyl)-1,3-dihydroindol-2-one
CID 62198656
5-(3-methoxy-4-methylbenzoyl)-1,3-dihydroindol-2-one
CID 43338590
6-(3,5-difluorobenzoyl)-4H-1,4-benzoxazin-3-one
CID 43339523
5-(2-iodobenzoyl)-1,3-dihydroindol-2-one
CID 43338616
5-(2-methylbenzoyl)-1,3-dihydroindol-2-one
CID 43160618
N-[3-(2-oxo-1,3-dihydroindole-5-carbonyl)phenyl]acetamide
CID 68698490
2-oxo-1,3-dihydroindole-5-carbonyl cyanide
CID 116918958

Frequently Asked Questions

What is the IUPAC name of 5-(3,5-difluorobenzoyl)-1,3-dihydroindol-2-one?
The IUPAC name of 5-(3,5-difluorobenzoyl)-1,3-dihydroindol-2-one (CID 43338600) is 5-(3,5-difluorobenzoyl)-1,3-dihydroindol-2-one.
What is the SMILES notation for 5-(3,5-difluorobenzoyl)-1,3-dihydroindol-2-one?
The canonical SMILES for 5-(3,5-difluorobenzoyl)-1,3-dihydroindol-2-one is O=C1Cc2cc(C(=O)c3cc(F)cc(F)c3)ccc2N1.
What is the InChIKey of 5-(3,5-difluorobenzoyl)-1,3-dihydroindol-2-one?
The InChIKey is UIFRNDUHUGPXGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H9F2NO2/c16-11-4-10(5-12(17)7-11)15(20)8-1-2-13-9(3-8)6-14(19)18-13/h1-5,7H,6H2,(H,18,19).
What are the key properties of 5-(3,5-difluorobenzoyl)-1,3-dihydroindol-2-one?
5-(3,5-difluorobenzoyl)-1,3-dihydroindol-2-one has a molecular weight of 273.24 g/mol, XLogP of 2.69, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(3,5-difluorobenzoyl)-1,3-dihydroindol-2-one is sourced from PubChem (CID 43338600), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).