6-chloro-5-(4-hydroxyphenyl)-1,3-dihydroindol-2-one

C14H10ClNO2 — CID 121317048

IUPAC6-chloro-5-(4-hydroxyphenyl)-1,3-dihydroindol-2-one
SMILESO=C1Cc2cc(-c3ccc(O)cc3)c(Cl)cc2N1
InChIInChI=1S/C14H10ClNO2/c15-12-7-13-9(6-14(18)16-13)5-11(12)8-1-3-10(17)4-2-8/h1-5,7,17H,6H2,(H,16,18)
InChIKeyIIPUBGAMXIVACA-UHFFFAOYSA-N
MW259.69 g/mol
LogP3.21
Rot. Bonds1

About 6-chloro-5-(4-hydroxyphenyl)-1,3-dihydroindol-2-one

6-chloro-5-(4-hydroxyphenyl)-1,3-dihydroindol-2-one (PubChem CID 121317048) has the molecular formula C14H10ClNO2 and a molecular weight of 259.69 g/mol. Its IUPAC name is 6-chloro-5-(4-hydroxyphenyl)-1,3-dihydroindol-2-one.

Molecular Properties

Compound Name6-chloro-5-(4-hydroxyphenyl)-1,3-dihydroindol-2-one
PubChem CID121317048
Molecular FormulaC14H10ClNO2
Molecular Weight259.69 g/mol
Exact Mass259.04
IUPAC Name6-chloro-5-(4-hydroxyphenyl)-1,3-dihydroindol-2-one
SMILESO=C1Cc2cc(-c3ccc(O)cc3)c(Cl)cc2N1
InChIInChI=1S/C14H10ClNO2/c15-12-7-13-9(6-14(18)16-13)5-11(12)8-1-3-10(17)4-2-8/h1-5,7,17H,6H2,(H,16,18)
InChIKeyIIPUBGAMXIVACA-UHFFFAOYSA-N
XLogP3.21
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.69
LogP ≤ 53.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

6-chloro-5-[4-(2-hydroxyethoxy)phenyl]-1,3-dihydroindol-2-one
CID 121317057
6-chloro-5-(3,4-dimethylphenyl)-1,3-dihydroindol-2-one
CID 144760752
6-(4-hydroxyphenyl)-1,3-dihydroindol-2-one
CID 68878128
4-(6-chlorospiro[1,3-dihydroindole-2,1'-cyclopropane]-5-yl)phenol
CID 144760738
6-chloro-5-[4-[(2S)-2-(hydroxymethyl)pyrrolidin-1-yl]phenyl]-1,3-dihydroindol-2-one
CID 121317051
3-[4-(6-chloro-2-oxo-1,3-dihydroindol-5-yl)phenyl]penta-1,3-dienyl-methyl-methylideneazanium
CID 123489133
4-chloro-3-(2-oxo-1,3-dihydroindol-5-yl)benzoic acid
CID 146216092
6-chloro-5-methyl-1,3-dihydroindol-2-one;ethane
CID 144928829
5-(2,4,6-trichlorophenyl)-1,3-dihydroindol-2-one
CID 147482882
6-chloro-5-[2-[[5-(4-hydroxyphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]acetyl]-1,3-dihydroindol-2-one
CID 135654711
5-(2-chloro-6-phenylphenyl)-1,3-dihydroindol-2-one
CID 122655598
6-amino-5-(4-tert-butylphenyl)-1,3-dihydroindol-2-one
CID 162059497

Frequently Asked Questions

What is the IUPAC name of 6-chloro-5-(4-hydroxyphenyl)-1,3-dihydroindol-2-one?
The IUPAC name of 6-chloro-5-(4-hydroxyphenyl)-1,3-dihydroindol-2-one (CID 121317048) is 6-chloro-5-(4-hydroxyphenyl)-1,3-dihydroindol-2-one.
What is the SMILES notation for 6-chloro-5-(4-hydroxyphenyl)-1,3-dihydroindol-2-one?
The canonical SMILES for 6-chloro-5-(4-hydroxyphenyl)-1,3-dihydroindol-2-one is O=C1Cc2cc(-c3ccc(O)cc3)c(Cl)cc2N1.
What is the InChIKey of 6-chloro-5-(4-hydroxyphenyl)-1,3-dihydroindol-2-one?
The InChIKey is IIPUBGAMXIVACA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10ClNO2/c15-12-7-13-9(6-14(18)16-13)5-11(12)8-1-3-10(17)4-2-8/h1-5,7,17H,6H2,(H,16,18).
What are the key properties of 6-chloro-5-(4-hydroxyphenyl)-1,3-dihydroindol-2-one?
6-chloro-5-(4-hydroxyphenyl)-1,3-dihydroindol-2-one has a molecular weight of 259.69 g/mol, XLogP of 3.21, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-5-(4-hydroxyphenyl)-1,3-dihydroindol-2-one is sourced from PubChem (CID 121317048), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).