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

C15H12Cl2N2O2 — CID 79344351

IUPAC5-chloro-6-(2-chlorophenoxy)-3-(methylamino)-1,3-dihydroindol-2-one
SMILESCNC1C(=O)Nc2cc(Oc3ccccc3Cl)c(Cl)cc21
InChIInChI=1S/C15H12Cl2N2O2/c1-18-14-8-6-10(17)13(7-11(8)19-15(14)20)21-12-5-3-2-4-9(12)16/h2-7,14,18H,1H3,(H,19,20)
InChIKeyYYGQXZNWAPSRSD-UHFFFAOYSA-N
MW323.18 g/mol
LogP4.00
Rot. Bonds3

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

5-chloro-6-(2-chlorophenoxy)-3-(methylamino)-1,3-dihydroindol-2-one (PubChem CID 79344351) has the molecular formula C15H12Cl2N2O2 and a molecular weight of 323.18 g/mol. Its IUPAC name is 5-chloro-6-(2-chlorophenoxy)-3-(methylamino)-1,3-dihydroindol-2-one.

Molecular Properties

Compound Name5-chloro-6-(2-chlorophenoxy)-3-(methylamino)-1,3-dihydroindol-2-one
PubChem CID79344351
Molecular FormulaC15H12Cl2N2O2
Molecular Weight323.18 g/mol
Exact Mass322.03
IUPAC Name5-chloro-6-(2-chlorophenoxy)-3-(methylamino)-1,3-dihydroindol-2-one
SMILESCNC1C(=O)Nc2cc(Oc3ccccc3Cl)c(Cl)cc21
InChIInChI=1S/C15H12Cl2N2O2/c1-18-14-8-6-10(17)13(7-11(8)19-15(14)20)21-12-5-3-2-4-9(12)16/h2-7,14,18H,1H3,(H,19,20)
InChIKeyYYGQXZNWAPSRSD-UHFFFAOYSA-N
XLogP4.00
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.18
LogP ≤ 54.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(3Z)-5-chloro-3-[[4-[3-(diethylamino)propoxy]phenyl]methylidene]-1H-indol-2-one
CID 71454179
2-(5-Chloro-3,3-dimethyl-2-oxo-2,3-dihydro-1H-indol-1-YL)-N-[(4-methoxyphenyl)methyl]acetamide
CID 53057396
2-(3-chloro-4-methoxyphenyl)-N-[(3S)-1-(3,5-dimethylphenyl)-2-oxopyrrolidin-3-yl]acetamide
CID 97553323
5-chloro-3-[3-(dimethylamino)propyl]-3-(2-fluorophenyl)-6-methoxy-1H-indol-2-one
CID 66618335
5-chloro-3-(2-fluorophenyl)-6-methoxy-3-[3-(4-methylpiperazin-1-yl)propyl]-1H-indol-2-one
CID 66618355
5-chloro-3-(3-chloropropyl)-3-(2-fluorophenyl)-6-methoxy-1H-indol-2-one
CID 66618494
5-Chloro-3-(2-fluorophenyl)-6-methoxy-1,3-dihydroindol-2-one
CID 66618555
6-[2-chloro-4-(trifluoromethyl)phenoxy]-1,3-dimethyl-3H-indol-2-one
CID 10360871
6-[2-Chloro-4-(trifluoromethyl)phenoxy]-3-methylsulfanyl-1,3-dihydroindol-2-one
CID 10429454
3-(3-Chloro-4-methoxyanilino)-6-fluoro-1,3-dihydroindol-2-one
CID 43095283
3-(3-Chloro-4-methoxyanilino)-5-fluoro-1,3-dihydroindol-2-one
CID 43106328
5-Chloro-3-(3-fluoro-4-methoxyanilino)-1,3-dihydroindol-2-one
CID 43380516

Frequently Asked Questions

What is the IUPAC name of 5-chloro-6-(2-chlorophenoxy)-3-(methylamino)-1,3-dihydroindol-2-one?
The IUPAC name of 5-chloro-6-(2-chlorophenoxy)-3-(methylamino)-1,3-dihydroindol-2-one (CID 79344351) is 5-chloro-6-(2-chlorophenoxy)-3-(methylamino)-1,3-dihydroindol-2-one.
What is the SMILES notation for 5-chloro-6-(2-chlorophenoxy)-3-(methylamino)-1,3-dihydroindol-2-one?
The canonical SMILES for 5-chloro-6-(2-chlorophenoxy)-3-(methylamino)-1,3-dihydroindol-2-one is CNC1C(=O)Nc2cc(Oc3ccccc3Cl)c(Cl)cc21.
What is the InChIKey of 5-chloro-6-(2-chlorophenoxy)-3-(methylamino)-1,3-dihydroindol-2-one?
The InChIKey is YYGQXZNWAPSRSD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12Cl2N2O2/c1-18-14-8-6-10(17)13(7-11(8)19-15(14)20)21-12-5-3-2-4-9(12)16/h2-7,14,18H,1H3,(H,19,20).
What are the key properties of 5-chloro-6-(2-chlorophenoxy)-3-(methylamino)-1,3-dihydroindol-2-one?
5-chloro-6-(2-chlorophenoxy)-3-(methylamino)-1,3-dihydroindol-2-one has a molecular weight of 323.18 g/mol, XLogP of 4.00, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-6-(2-chlorophenoxy)-3-(methylamino)-1,3-dihydroindol-2-one is sourced from PubChem (CID 79344351), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).