6-chloro-5-(2-chloro-6-fluorobenzoyl)-1,3-dihydroindol-2-one

C15H8Cl2FNO2 — CID 43457450

IUPAC6-chloro-5-(2-chloro-6-fluorobenzoyl)-1,3-dihydroindol-2-one
SMILESO=C1Cc2cc(C(=O)c3c(F)cccc3Cl)c(Cl)cc2N1
InChIInChI=1S/C15H8Cl2FNO2/c16-9-2-1-3-11(18)14(9)15(21)8-4-7-5-13(20)19-12(7)6-10(8)17/h1-4,6H,5H2,(H,19,20)
InChIKeyCDQXBOBOYCLUGU-UHFFFAOYSA-N
MW324.14 g/mol
LogP3.86
Rot. Bonds2

About 6-chloro-5-(2-chloro-6-fluorobenzoyl)-1,3-dihydroindol-2-one

6-chloro-5-(2-chloro-6-fluorobenzoyl)-1,3-dihydroindol-2-one (PubChem CID 43457450) has the molecular formula C15H8Cl2FNO2 and a molecular weight of 324.14 g/mol. Its IUPAC name is 6-chloro-5-(2-chloro-6-fluorobenzoyl)-1,3-dihydroindol-2-one.

Molecular Properties

Compound Name6-chloro-5-(2-chloro-6-fluorobenzoyl)-1,3-dihydroindol-2-one
PubChem CID43457450
Molecular FormulaC15H8Cl2FNO2
Molecular Weight324.14 g/mol
Exact Mass322.99
IUPAC Name6-chloro-5-(2-chloro-6-fluorobenzoyl)-1,3-dihydroindol-2-one
SMILESO=C1Cc2cc(C(=O)c3c(F)cccc3Cl)c(Cl)cc2N1
InChIInChI=1S/C15H8Cl2FNO2/c16-9-2-1-3-11(18)14(9)15(21)8-4-7-5-13(20)19-12(7)6-10(8)17/h1-4,6H,5H2,(H,19,20)
InChIKeyCDQXBOBOYCLUGU-UHFFFAOYSA-N
XLogP3.86
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.14
LogP ≤ 53.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-(3-bromo-5-fluorobenzoyl)-6-chloro-1,3-dihydroindol-2-one
CID 43457411
6-chloro-5-(2-chloro-4-methylbenzoyl)-1,3-dihydroindol-2-one
CID 106860794
6-chloro-5-(2,4,5-trimethylfuran-3-carbonyl)-1,3-dihydroindol-2-one
CID 65151637
5-(2-amino-5-methylbenzoyl)-6-chloro-1,3-dihydroindol-2-one
CID 65454554
6-chloro-5-(pyridine-3-carbonyl)-1,3-dihydroindol-2-one
CID 43457490
6-chloro-5-(3-chloro-4-iodobenzoyl)-1,3-dihydroindol-2-one
CID 103219673
5-(2-bromofuran-3-carbonyl)-6-chloro-1,3-dihydroindol-2-one
CID 106851318
6-chloro-5-(4,5-dibromothiophene-2-carbonyl)-1,3-dihydroindol-2-one
CID 80536252
5-(5-bromo-4-methylthiophene-2-carbonyl)-6-chloro-1,3-dihydroindol-2-one
CID 79981558
5-[amino-(2-chloro-6-fluorophenyl)methyl]-6-chloro-1,3-dihydroindol-2-one
CID 43457610
5-(2-bromoacetyl)-6-chloro-1,3-dihydroindol-2-one
CID 10541398
6-chloro-5-(1-methylcyclohexanecarbonyl)-1,3-dihydroindol-2-one
CID 106826590

Frequently Asked Questions

What is the IUPAC name of 6-chloro-5-(2-chloro-6-fluorobenzoyl)-1,3-dihydroindol-2-one?
The IUPAC name of 6-chloro-5-(2-chloro-6-fluorobenzoyl)-1,3-dihydroindol-2-one (CID 43457450) is 6-chloro-5-(2-chloro-6-fluorobenzoyl)-1,3-dihydroindol-2-one.
What is the SMILES notation for 6-chloro-5-(2-chloro-6-fluorobenzoyl)-1,3-dihydroindol-2-one?
The canonical SMILES for 6-chloro-5-(2-chloro-6-fluorobenzoyl)-1,3-dihydroindol-2-one is O=C1Cc2cc(C(=O)c3c(F)cccc3Cl)c(Cl)cc2N1.
What is the InChIKey of 6-chloro-5-(2-chloro-6-fluorobenzoyl)-1,3-dihydroindol-2-one?
The InChIKey is CDQXBOBOYCLUGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H8Cl2FNO2/c16-9-2-1-3-11(18)14(9)15(21)8-4-7-5-13(20)19-12(7)6-10(8)17/h1-4,6H,5H2,(H,19,20).
What are the key properties of 6-chloro-5-(2-chloro-6-fluorobenzoyl)-1,3-dihydroindol-2-one?
6-chloro-5-(2-chloro-6-fluorobenzoyl)-1,3-dihydroindol-2-one has a molecular weight of 324.14 g/mol, XLogP of 3.86, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-5-(2-chloro-6-fluorobenzoyl)-1,3-dihydroindol-2-one is sourced from PubChem (CID 43457450), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).