(2,4-dichloro-6-hydroxyphenyl)-(2,3-dihydroindol-1-yl)methanone

C15H11Cl2NO2 — CID 155551821

IUPAC(2,4-dichloro-6-hydroxyphenyl)-(2,3-dihydroindol-1-yl)methanone
SMILESO=C(c1c(O)cc(Cl)cc1Cl)N1CCc2ccccc21
InChIInChI=1S/C15H11Cl2NO2/c16-10-7-11(17)14(13(19)8-10)15(20)18-6-5-9-3-1-2-4-12(9)18/h1-4,7-8,19H,5-6H2
InChIKeyXZNPXNGGADWRKR-UHFFFAOYSA-N
MW308.16 g/mol
LogP3.90
Rot. Bonds1

About (2,4-dichloro-6-hydroxyphenyl)-(2,3-dihydroindol-1-yl)methanone

(2,4-dichloro-6-hydroxyphenyl)-(2,3-dihydroindol-1-yl)methanone (PubChem CID 155551821) has the molecular formula C15H11Cl2NO2 and a molecular weight of 308.16 g/mol. Its IUPAC name is (2,4-dichloro-6-hydroxyphenyl)-(2,3-dihydroindol-1-yl)methanone.

Molecular Properties

Compound Name(2,4-dichloro-6-hydroxyphenyl)-(2,3-dihydroindol-1-yl)methanone
PubChem CID155551821
Molecular FormulaC15H11Cl2NO2
Molecular Weight308.16 g/mol
Exact Mass307.02
IUPAC Name(2,4-dichloro-6-hydroxyphenyl)-(2,3-dihydroindol-1-yl)methanone
SMILESO=C(c1c(O)cc(Cl)cc1Cl)N1CCc2ccccc21
InChIInChI=1S/C15H11Cl2NO2/c16-10-7-11(17)14(13(19)8-10)15(20)18-6-5-9-3-1-2-4-12(9)18/h1-4,7-8,19H,5-6H2
InChIKeyXZNPXNGGADWRKR-UHFFFAOYSA-N
XLogP3.90
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.16
LogP ≤ 53.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (2,4-dichloro-6-hydroxyphenyl)-(2,3-dihydroindol-1-yl)methanone?
The IUPAC name of (2,4-dichloro-6-hydroxyphenyl)-(2,3-dihydroindol-1-yl)methanone (CID 155551821) is (2,4-dichloro-6-hydroxyphenyl)-(2,3-dihydroindol-1-yl)methanone.
What is the SMILES notation for (2,4-dichloro-6-hydroxyphenyl)-(2,3-dihydroindol-1-yl)methanone?
The canonical SMILES for (2,4-dichloro-6-hydroxyphenyl)-(2,3-dihydroindol-1-yl)methanone is O=C(c1c(O)cc(Cl)cc1Cl)N1CCc2ccccc21.
What is the InChIKey of (2,4-dichloro-6-hydroxyphenyl)-(2,3-dihydroindol-1-yl)methanone?
The InChIKey is XZNPXNGGADWRKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11Cl2NO2/c16-10-7-11(17)14(13(19)8-10)15(20)18-6-5-9-3-1-2-4-12(9)18/h1-4,7-8,19H,5-6H2.
What are the key properties of (2,4-dichloro-6-hydroxyphenyl)-(2,3-dihydroindol-1-yl)methanone?
(2,4-dichloro-6-hydroxyphenyl)-(2,3-dihydroindol-1-yl)methanone has a molecular weight of 308.16 g/mol, XLogP of 3.90, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2,4-dichloro-6-hydroxyphenyl)-(2,3-dihydroindol-1-yl)methanone is sourced from PubChem (CID 155551821), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).