3-(3,5-dichlorophenyl)imino-1H-indol-2-one

C14H8Cl2N2O — CID 135517981

IUPAC3-(3,5-dichlorophenyl)imino-1H-indol-2-one
SMILESO=C1Nc2ccccc2/C1=N/c1cc(Cl)cc(Cl)c1
InChIInChI=1S/C14H8Cl2N2O/c15-8-5-9(16)7-10(6-8)17-13-11-3-1-2-4-12(11)18-14(13)19/h1-7H,(H,17,18,19)
InChIKeyAREDEJPEVCJUKC-UHFFFAOYSA-N
MW291.14 g/mol
LogP4.07
Rot. Bonds1

About 3-(3,5-dichlorophenyl)imino-1H-indol-2-one

3-(3,5-dichlorophenyl)imino-1H-indol-2-one (PubChem CID 135517981) has the molecular formula C14H8Cl2N2O and a molecular weight of 291.14 g/mol. Its IUPAC name is 3-(3,5-dichlorophenyl)imino-1H-indol-2-one.

Molecular Properties

Compound Name3-(3,5-dichlorophenyl)imino-1H-indol-2-one
PubChem CID135517981
Molecular FormulaC14H8Cl2N2O
Molecular Weight291.14 g/mol
Exact Mass290.00
IUPAC Name3-(3,5-dichlorophenyl)imino-1H-indol-2-one
SMILESO=C1Nc2ccccc2/C1=N/c1cc(Cl)cc(Cl)c1
InChIInChI=1S/C14H8Cl2N2O/c15-8-5-9(16)7-10(6-8)17-13-11-3-1-2-4-12(11)18-14(13)19/h1-7H,(H,17,18,19)
InChIKeyAREDEJPEVCJUKC-UHFFFAOYSA-N
XLogP4.07
TPSA41.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.14
LogP ≤ 54.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Related Compounds

Diclofenac lactam
CID 27211
6-Chloro-1,3-dihydroindol-2-one
CID 736344
3-((4-Chlorophenyl)imino)indolin-2-one
CID 135411931
3-(4-Methylanilino)indol-2-one
CID 135412515
2-Indolinone, 3-(phenylimino)-
CID 135442567
7-Chloro-3-(3-methylanilino)indol-2-one
CID 135444078
(3Z)-3-{[3-(trifluoromethyl)phenyl]imino}-1,3-dihydro-2H-indol-2-one
CID 135411930
(3Z)-3-(2-chlorobenzylidene)-1,3-dihydro-2H-indol-2-one
CID 727521
(E)-3-(2,3-dichlorophenylimino)indolin-2-one
CID 135559217
3-(Biphenyl-2-ylamino)-2h-indol-2-one
CID 135478723
3-(4-Fluoroanilino)indol-2-one
CID 135478724
3-(3,4-Dichlorophenyl)imino-1-prop-2-enylindol-2-one
CID 3561805

Frequently Asked Questions

What is the IUPAC name of 3-(3,5-dichlorophenyl)imino-1H-indol-2-one?
The IUPAC name of 3-(3,5-dichlorophenyl)imino-1H-indol-2-one (CID 135517981) is 3-(3,5-dichlorophenyl)imino-1H-indol-2-one.
What is the SMILES notation for 3-(3,5-dichlorophenyl)imino-1H-indol-2-one?
The canonical SMILES for 3-(3,5-dichlorophenyl)imino-1H-indol-2-one is O=C1Nc2ccccc2/C1=N/c1cc(Cl)cc(Cl)c1.
What is the InChIKey of 3-(3,5-dichlorophenyl)imino-1H-indol-2-one?
The InChIKey is AREDEJPEVCJUKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H8Cl2N2O/c15-8-5-9(16)7-10(6-8)17-13-11-3-1-2-4-12(11)18-14(13)19/h1-7H,(H,17,18,19).
What are the key properties of 3-(3,5-dichlorophenyl)imino-1H-indol-2-one?
3-(3,5-dichlorophenyl)imino-1H-indol-2-one has a molecular weight of 291.14 g/mol, XLogP of 4.07, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3,5-dichlorophenyl)imino-1H-indol-2-one is sourced from PubChem (CID 135517981), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).