2-(2,4-dichlorophenyl)-5-methyl-1H-indole

C15H11Cl2N — CID 131886780

IUPAC2-(2,4-dichlorophenyl)-5-methyl-1H-indole
SMILESCc1ccc2[nH]c(-c3ccc(Cl)cc3Cl)cc2c1
InChIInChI=1S/C15H11Cl2N/c1-9-2-5-14-10(6-9)7-15(18-14)12-4-3-11(16)8-13(12)17/h2-8,18H,1H3
InChIKeyQGBBRBVRNIKUOV-UHFFFAOYSA-N
MW276.17 g/mol
LogP5.45
Rot. Bonds1

About 2-(2,4-dichlorophenyl)-5-methyl-1H-indole

2-(2,4-dichlorophenyl)-5-methyl-1H-indole (PubChem CID 131886780) has the molecular formula C15H11Cl2N and a molecular weight of 276.17 g/mol. Its IUPAC name is 2-(2,4-dichlorophenyl)-5-methyl-1H-indole.

Molecular Properties

Compound Name2-(2,4-dichlorophenyl)-5-methyl-1H-indole
PubChem CID131886780
Molecular FormulaC15H11Cl2N
Molecular Weight276.17 g/mol
Exact Mass275.03
IUPAC Name2-(2,4-dichlorophenyl)-5-methyl-1H-indole
SMILESCc1ccc2[nH]c(-c3ccc(Cl)cc3Cl)cc2c1
InChIInChI=1S/C15H11Cl2N/c1-9-2-5-14-10(6-9)7-15(18-14)12-4-3-11(16)8-13(12)17/h2-8,18H,1H3
InChIKeyQGBBRBVRNIKUOV-UHFFFAOYSA-N
XLogP5.45
TPSA15.79 Ų
H-Bond Donors1
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500276.17
LogP ≤ 55.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 100

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Related Compounds

6-chloro-3-(5-methyl-1H-indol-2-yl)-1H-indazole
CID 135409284
2-(5-chlorothiophen-2-yl)-5-methyl-1H-indole
CID 131886787
4-(5-methyl-1H-indol-2-yl)aniline
CID 15322512
2-(3,4-dimethylphenyl)-5-methyl-1H-indole
CID 36688011
6-chloro-3-(4-methylphenyl)-1H-quinolin-2-one
CID 166443744
5-chloro-2-methyl-1H-indole;ethane
CID 143548586
2-(2,4-dichlorophenyl)-4-methylphenol
CID 83130752
2-(4-tert-butylphenyl)-5-methyl-1H-indole
CID 36688009
N-[2-(5-methyl-1H-indol-2-yl)phenyl]acetamide
CID 134835281
5-(5-chloro-1H-indol-2-yl)-2-methylaniline
CID 39358848
2-(2-chlorophenyl)-1H-indol-5-ol
CID 84704114
5-bromo-2-(2-chlorophenyl)-1H-indole
CID 58200676

Frequently Asked Questions

What is the IUPAC name of 2-(2,4-dichlorophenyl)-5-methyl-1H-indole?
The IUPAC name of 2-(2,4-dichlorophenyl)-5-methyl-1H-indole (CID 131886780) is 2-(2,4-dichlorophenyl)-5-methyl-1H-indole.
What is the SMILES notation for 2-(2,4-dichlorophenyl)-5-methyl-1H-indole?
The canonical SMILES for 2-(2,4-dichlorophenyl)-5-methyl-1H-indole is Cc1ccc2[nH]c(-c3ccc(Cl)cc3Cl)cc2c1.
What is the InChIKey of 2-(2,4-dichlorophenyl)-5-methyl-1H-indole?
The InChIKey is QGBBRBVRNIKUOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11Cl2N/c1-9-2-5-14-10(6-9)7-15(18-14)12-4-3-11(16)8-13(12)17/h2-8,18H,1H3.
What are the key properties of 2-(2,4-dichlorophenyl)-5-methyl-1H-indole?
2-(2,4-dichlorophenyl)-5-methyl-1H-indole has a molecular weight of 276.17 g/mol, XLogP of 5.45, 1 rotatable bonds, 1 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-dichlorophenyl)-5-methyl-1H-indole is sourced from PubChem (CID 131886780), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).