2-(2,4-dichlorophenyl)-2,3-dihydro-1H-indole

C14H11Cl2N — CID 4019542

IUPAC2-(2,4-dichlorophenyl)-2,3-dihydro-1H-indole
SMILESClc1ccc(C2Cc3ccccc3N2)c(Cl)c1
InChIInChI=1S/C14H11Cl2N/c15-10-5-6-11(12(16)8-10)14-7-9-3-1-2-4-13(9)17-14/h1-6,8,14,17H,7H2
InChIKeyQMXSRJUHKANFHO-UHFFFAOYSA-N
MW264.16 g/mol
LogP4.70
Rot. Bonds1

About 2-(2,4-dichlorophenyl)-2,3-dihydro-1H-indole

2-(2,4-dichlorophenyl)-2,3-dihydro-1H-indole (PubChem CID 4019542) has the molecular formula C14H11Cl2N and a molecular weight of 264.16 g/mol. Its IUPAC name is 2-(2,4-dichlorophenyl)-2,3-dihydro-1H-indole.

Molecular Properties

Compound Name2-(2,4-dichlorophenyl)-2,3-dihydro-1H-indole
PubChem CID4019542
Molecular FormulaC14H11Cl2N
Molecular Weight264.16 g/mol
Exact Mass263.03
IUPAC Name2-(2,4-dichlorophenyl)-2,3-dihydro-1H-indole
SMILESClc1ccc(C2Cc3ccccc3N2)c(Cl)c1
InChIInChI=1S/C14H11Cl2N/c15-10-5-6-11(12(16)8-10)14-7-9-3-1-2-4-13(9)17-14/h1-6,8,14,17H,7H2
InChIKeyQMXSRJUHKANFHO-UHFFFAOYSA-N
XLogP4.70
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.16
LogP ≤ 54.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-(2,4-dichlorophenyl)-2,3-dihydro-1H-indole?
The IUPAC name of 2-(2,4-dichlorophenyl)-2,3-dihydro-1H-indole (CID 4019542) is 2-(2,4-dichlorophenyl)-2,3-dihydro-1H-indole.
What is the SMILES notation for 2-(2,4-dichlorophenyl)-2,3-dihydro-1H-indole?
The canonical SMILES for 2-(2,4-dichlorophenyl)-2,3-dihydro-1H-indole is Clc1ccc(C2Cc3ccccc3N2)c(Cl)c1.
What is the InChIKey of 2-(2,4-dichlorophenyl)-2,3-dihydro-1H-indole?
The InChIKey is QMXSRJUHKANFHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11Cl2N/c15-10-5-6-11(12(16)8-10)14-7-9-3-1-2-4-13(9)17-14/h1-6,8,14,17H,7H2.
What are the key properties of 2-(2,4-dichlorophenyl)-2,3-dihydro-1H-indole?
2-(2,4-dichlorophenyl)-2,3-dihydro-1H-indole has a molecular weight of 264.16 g/mol, XLogP of 4.70, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-dichlorophenyl)-2,3-dihydro-1H-indole is sourced from PubChem (CID 4019542), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).