2-(2-chlorophenyl)-6,7-dimethyl-1H-indole

C16H14ClN — CID 131886906

IUPAC2-(2-chlorophenyl)-6,7-dimethyl-1H-indole
SMILESCc1ccc2cc(-c3ccccc3Cl)[nH]c2c1C
InChIInChI=1S/C16H14ClN/c1-10-7-8-12-9-15(18-16(12)11(10)2)13-5-3-4-6-14(13)17/h3-9,18H,1-2H3
InChIKeyUIXXIYMYPQWBRT-UHFFFAOYSA-N
MW255.75 g/mol
LogP5.11
Rot. Bonds1

About 2-(2-chlorophenyl)-6,7-dimethyl-1H-indole

2-(2-chlorophenyl)-6,7-dimethyl-1H-indole (PubChem CID 131886906) has the molecular formula C16H14ClN and a molecular weight of 255.75 g/mol. Its IUPAC name is 2-(2-chlorophenyl)-6,7-dimethyl-1H-indole.

Molecular Properties

Compound Name2-(2-chlorophenyl)-6,7-dimethyl-1H-indole
PubChem CID131886906
Molecular FormulaC16H14ClN
Molecular Weight255.75 g/mol
Exact Mass255.08
IUPAC Name2-(2-chlorophenyl)-6,7-dimethyl-1H-indole
SMILESCc1ccc2cc(-c3ccccc3Cl)[nH]c2c1C
InChIInChI=1S/C16H14ClN/c1-10-7-8-12-9-15(18-16(12)11(10)2)13-5-3-4-6-14(13)17/h3-9,18H,1-2H3
InChIKeyUIXXIYMYPQWBRT-UHFFFAOYSA-N
XLogP5.11
TPSA15.79 Ų
H-Bond Donors1
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500255.75
LogP ≤ 55.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 100

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Related Compounds

2-(4-fluorophenyl)-6,7-dimethyl-1H-indole
CID 131886920
6-(2-chlorophenyl)-2-methyl-1H-pyrimidine-4-thione
CID 106515465
2-(2-chlorophenyl)-1H-indol-5-ol
CID 84704114
5-bromo-2-(2-chlorophenyl)-1H-indole
CID 58200676
2-(2-chlorophenyl)-5-methyl-3H-pyrrolo[2,3-c]quinolin-4-one
CID 72546975
[2-(3-bromo-2-methylphenyl)-7-chloro-1H-indol-5-yl]methanol
CID 172561146
7-chloro-8-methyl-3-phenyl-1H-quinolin-2-one
CID 39346054
4-bromo-2-(2-chlorophenyl)-1H-indole
CID 59689098
methyl 2-chloro-5-(2-methylphenyl)-1H-pyrrole-3-carboxylate
CID 66924907
7-bromo-2-(2,5-dimethylphenyl)-1H-indole
CID 131886878
2-(2-bromophenyl)-5,7-dimethyl-1H-indole
CID 131886941
4-(2-chlorophenyl)-3H-1,3-oxazine-2,6-dione
CID 586793

Frequently Asked Questions

What is the IUPAC name of 2-(2-chlorophenyl)-6,7-dimethyl-1H-indole?
The IUPAC name of 2-(2-chlorophenyl)-6,7-dimethyl-1H-indole (CID 131886906) is 2-(2-chlorophenyl)-6,7-dimethyl-1H-indole.
What is the SMILES notation for 2-(2-chlorophenyl)-6,7-dimethyl-1H-indole?
The canonical SMILES for 2-(2-chlorophenyl)-6,7-dimethyl-1H-indole is Cc1ccc2cc(-c3ccccc3Cl)[nH]c2c1C.
What is the InChIKey of 2-(2-chlorophenyl)-6,7-dimethyl-1H-indole?
The InChIKey is UIXXIYMYPQWBRT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14ClN/c1-10-7-8-12-9-15(18-16(12)11(10)2)13-5-3-4-6-14(13)17/h3-9,18H,1-2H3.
What are the key properties of 2-(2-chlorophenyl)-6,7-dimethyl-1H-indole?
2-(2-chlorophenyl)-6,7-dimethyl-1H-indole has a molecular weight of 255.75 g/mol, XLogP of 5.11, 1 rotatable bonds, 1 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chlorophenyl)-6,7-dimethyl-1H-indole is sourced from PubChem (CID 131886906), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).