7-chloro-5-(3,5-dichloro-4-pyridinyl)-1,3-dihydroindol-2-one

C13H7Cl3N2O — CID 122655698

IUPAC7-chloro-5-(3,5-dichloro-4-pyridinyl)-1,3-dihydroindol-2-one
SMILESO=C1Cc2cc(-c3c(Cl)cncc3Cl)cc(Cl)c2N1
InChIInChI=1S/C13H7Cl3N2O/c14-8-2-6(1-7-3-11(19)18-13(7)8)12-9(15)4-17-5-10(12)16/h1-2,4-5H,3H2,(H,18,19)
InChIKeyKFFVWKKOWNPXME-UHFFFAOYSA-N
MW313.57 g/mol
LogP4.20
Rot. Bonds1

About 7-chloro-5-(3,5-dichloro-4-pyridinyl)-1,3-dihydroindol-2-one

7-chloro-5-(3,5-dichloro-4-pyridinyl)-1,3-dihydroindol-2-one (PubChem CID 122655698) has the molecular formula C13H7Cl3N2O and a molecular weight of 313.57 g/mol. Its IUPAC name is 7-chloro-5-(3,5-dichloro-4-pyridinyl)-1,3-dihydroindol-2-one.

Molecular Properties

Compound Name7-chloro-5-(3,5-dichloro-4-pyridinyl)-1,3-dihydroindol-2-one
PubChem CID122655698
Molecular FormulaC13H7Cl3N2O
Molecular Weight313.57 g/mol
Exact Mass311.96
IUPAC Name7-chloro-5-(3,5-dichloro-4-pyridinyl)-1,3-dihydroindol-2-one
SMILESO=C1Cc2cc(-c3c(Cl)cncc3Cl)cc(Cl)c2N1
InChIInChI=1S/C13H7Cl3N2O/c14-8-2-6(1-7-3-11(19)18-13(7)8)12-9(15)4-17-5-10(12)16/h1-2,4-5H,3H2,(H,18,19)
InChIKeyKFFVWKKOWNPXME-UHFFFAOYSA-N
XLogP4.20
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.57
LogP ≤ 54.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-(3-chloro-5-methyl-4-pyridinyl)-7-methyl-1,3-dihydroindol-2-one
CID 134472954
7-fluoro-5-(5-fluoro-3-pyridinyl)-1,3-dihydroindol-2-one
CID 58255499
5-(2,4,6-trichlorophenyl)-1,3-dihydroindol-2-one
CID 147482882
5-tert-butyl-7-chloro-1,3-dihydroindol-2-one;5-tert-butyl-7-methyl-1,3-dihydroindol-2-one
CID 159953490
2-(7-chloro-2-oxo-1,3-dihydroindol-5-yl)acetonitrile
CID 84779277
5-(1-aminocyclohexyl)-7-chloro-1,3-dihydroindol-2-one
CID 117416260
7-chloro-5-[2-propan-2-yl-6-(trifluoromethyl)pyrazolo[1,5-a]pyridin-7-yl]-1,3-dihydroindol-2-one
CID 134458123
7-chloro-1,3-dihydropyrrolo[2,3-c]pyridin-2-one
CID 10749642
7-(5-amino-1H-pyrazol-4-yl)-5-chloro-1,3-dihydroindol-2-one
CID 117374889
7-[(E)-3-aminoprop-1-enyl]-5-chloro-1,3-dihydroindol-2-one
CID 117318863
5-(3-amino-1H-pyrazol-5-yl)-7-fluoro-1,3-dihydroindol-2-one
CID 117335864
8-chloro-6-hydroxy-3,4-dihydro-1H-quinolin-2-one
CID 14268518

Frequently Asked Questions

What is the IUPAC name of 7-chloro-5-(3,5-dichloro-4-pyridinyl)-1,3-dihydroindol-2-one?
The IUPAC name of 7-chloro-5-(3,5-dichloro-4-pyridinyl)-1,3-dihydroindol-2-one (CID 122655698) is 7-chloro-5-(3,5-dichloro-4-pyridinyl)-1,3-dihydroindol-2-one.
What is the SMILES notation for 7-chloro-5-(3,5-dichloro-4-pyridinyl)-1,3-dihydroindol-2-one?
The canonical SMILES for 7-chloro-5-(3,5-dichloro-4-pyridinyl)-1,3-dihydroindol-2-one is O=C1Cc2cc(-c3c(Cl)cncc3Cl)cc(Cl)c2N1.
What is the InChIKey of 7-chloro-5-(3,5-dichloro-4-pyridinyl)-1,3-dihydroindol-2-one?
The InChIKey is KFFVWKKOWNPXME-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H7Cl3N2O/c14-8-2-6(1-7-3-11(19)18-13(7)8)12-9(15)4-17-5-10(12)16/h1-2,4-5H,3H2,(H,18,19).
What are the key properties of 7-chloro-5-(3,5-dichloro-4-pyridinyl)-1,3-dihydroindol-2-one?
7-chloro-5-(3,5-dichloro-4-pyridinyl)-1,3-dihydroindol-2-one has a molecular weight of 313.57 g/mol, XLogP of 4.20, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-chloro-5-(3,5-dichloro-4-pyridinyl)-1,3-dihydroindol-2-one is sourced from PubChem (CID 122655698), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).