7-chloro-2-(5-chloro-2-methoxyphenyl)-2,3-dihydro-1H-indole

C15H13Cl2NO — CID 3469469

IUPAC7-chloro-2-(5-chloro-2-methoxyphenyl)-2,3-dihydro-1H-indole
SMILESCOc1ccc(Cl)cc1C1Cc2cccc(Cl)c2N1
InChIInChI=1S/C15H13Cl2NO/c1-19-14-6-5-10(16)8-11(14)13-7-9-3-2-4-12(17)15(9)18-13/h2-6,8,13,18H,7H2,1H3
InChIKeyZDQUTGXQJYCYSH-UHFFFAOYSA-N
MW294.18 g/mol
LogP4.71
Rot. Bonds2

About 7-chloro-2-(5-chloro-2-methoxyphenyl)-2,3-dihydro-1H-indole

7-chloro-2-(5-chloro-2-methoxyphenyl)-2,3-dihydro-1H-indole (PubChem CID 3469469) has the molecular formula C15H13Cl2NO and a molecular weight of 294.18 g/mol. Its IUPAC name is 7-chloro-2-(5-chloro-2-methoxyphenyl)-2,3-dihydro-1H-indole.

Molecular Properties

Compound Name7-chloro-2-(5-chloro-2-methoxyphenyl)-2,3-dihydro-1H-indole
PubChem CID3469469
Molecular FormulaC15H13Cl2NO
Molecular Weight294.18 g/mol
Exact Mass293.04
IUPAC Name7-chloro-2-(5-chloro-2-methoxyphenyl)-2,3-dihydro-1H-indole
SMILESCOc1ccc(Cl)cc1C1Cc2cccc(Cl)c2N1
InChIInChI=1S/C15H13Cl2NO/c1-19-14-6-5-10(16)8-11(14)13-7-9-3-2-4-12(17)15(9)18-13/h2-6,8,13,18H,7H2,1H3
InChIKeyZDQUTGXQJYCYSH-UHFFFAOYSA-N
XLogP4.71
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.18
LogP ≤ 54.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 7-chloro-2-(5-chloro-2-methoxyphenyl)-2,3-dihydro-1H-indole?
The IUPAC name of 7-chloro-2-(5-chloro-2-methoxyphenyl)-2,3-dihydro-1H-indole (CID 3469469) is 7-chloro-2-(5-chloro-2-methoxyphenyl)-2,3-dihydro-1H-indole.
What is the SMILES notation for 7-chloro-2-(5-chloro-2-methoxyphenyl)-2,3-dihydro-1H-indole?
The canonical SMILES for 7-chloro-2-(5-chloro-2-methoxyphenyl)-2,3-dihydro-1H-indole is COc1ccc(Cl)cc1C1Cc2cccc(Cl)c2N1.
What is the InChIKey of 7-chloro-2-(5-chloro-2-methoxyphenyl)-2,3-dihydro-1H-indole?
The InChIKey is ZDQUTGXQJYCYSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13Cl2NO/c1-19-14-6-5-10(16)8-11(14)13-7-9-3-2-4-12(17)15(9)18-13/h2-6,8,13,18H,7H2,1H3.
What are the key properties of 7-chloro-2-(5-chloro-2-methoxyphenyl)-2,3-dihydro-1H-indole?
7-chloro-2-(5-chloro-2-methoxyphenyl)-2,3-dihydro-1H-indole has a molecular weight of 294.18 g/mol, XLogP of 4.71, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-chloro-2-(5-chloro-2-methoxyphenyl)-2,3-dihydro-1H-indole is sourced from PubChem (CID 3469469), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).