7-fluoro-5-methyl-2-(4-methylphenyl)-1H-indole

C16H14FN — CID 156815950

IUPAC7-fluoro-5-methyl-2-(4-methylphenyl)-1H-indole
SMILESCc1ccc(-c2cc3cc(C)cc(F)c3[nH]2)cc1
InChIInChI=1S/C16H14FN/c1-10-3-5-12(6-4-10)15-9-13-7-11(2)8-14(17)16(13)18-15/h3-9,18H,1-2H3
InChIKeyDELPPTFQVJAVIE-UHFFFAOYSA-N
MW239.29 g/mol
LogP4.59
Rot. Bonds1

About 7-fluoro-5-methyl-2-(4-methylphenyl)-1H-indole

7-fluoro-5-methyl-2-(4-methylphenyl)-1H-indole (PubChem CID 156815950) has the molecular formula C16H14FN and a molecular weight of 239.29 g/mol. Its IUPAC name is 7-fluoro-5-methyl-2-(4-methylphenyl)-1H-indole.

Molecular Properties

Compound Name7-fluoro-5-methyl-2-(4-methylphenyl)-1H-indole
PubChem CID156815950
Molecular FormulaC16H14FN
Molecular Weight239.29 g/mol
Exact Mass239.11
IUPAC Name7-fluoro-5-methyl-2-(4-methylphenyl)-1H-indole
SMILESCc1ccc(-c2cc3cc(C)cc(F)c3[nH]2)cc1
InChIInChI=1S/C16H14FN/c1-10-3-5-12(6-4-10)15-9-13-7-11(2)8-14(17)16(13)18-15/h3-9,18H,1-2H3
InChIKeyDELPPTFQVJAVIE-UHFFFAOYSA-N
XLogP4.59
TPSA15.79 Ų
H-Bond Donors1
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.29
LogP ≤ 54.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 100

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Related Compounds

5,7-dimethyl-2-(4-methylphenyl)-1H-indole
CID 131886944
7-fluoro-2-(4-methylphenyl)-1H-indole
CID 131886972
5,7-difluoro-2-(4-fluorophenyl)-1H-indole;methylcyclobutane
CID 156816458
2-(4-ethylphenyl)-5,7-dimethyl-1H-indole
CID 131886815
2-(4-fluorophenyl)-6,7-dimethyl-1H-indole
CID 131886920
4-(7-fluoro-1H-indol-2-yl)aniline
CID 71602424
cyclobutanol;cyclopropanamine;5,7-difluoro-2-(4-fluorophenyl)-1H-indole;propane
CID 156816192
2-(2,5-dimethylphenyl)-5,7-dimethyl-1H-indole
CID 131886954
4-(5-methyl-1H-indol-2-yl)aniline
CID 15322512
cyclobutyl N-(1-amino-1-oxopropan-2-yl)carbamate;5,7-difluoro-2-(4-fluorophenyl)-1H-indole;ethane
CID 162389670
2-(4-tert-butylphenyl)-5-methyl-1H-indole
CID 36688009
7-fluoro-5-methyl-2-pyrrolidin-1-ylsulfanyl-1H-indole
CID 171810319

Frequently Asked Questions

What is the IUPAC name of 7-fluoro-5-methyl-2-(4-methylphenyl)-1H-indole?
The IUPAC name of 7-fluoro-5-methyl-2-(4-methylphenyl)-1H-indole (CID 156815950) is 7-fluoro-5-methyl-2-(4-methylphenyl)-1H-indole.
What is the SMILES notation for 7-fluoro-5-methyl-2-(4-methylphenyl)-1H-indole?
The canonical SMILES for 7-fluoro-5-methyl-2-(4-methylphenyl)-1H-indole is Cc1ccc(-c2cc3cc(C)cc(F)c3[nH]2)cc1.
What is the InChIKey of 7-fluoro-5-methyl-2-(4-methylphenyl)-1H-indole?
The InChIKey is DELPPTFQVJAVIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14FN/c1-10-3-5-12(6-4-10)15-9-13-7-11(2)8-14(17)16(13)18-15/h3-9,18H,1-2H3.
What are the key properties of 7-fluoro-5-methyl-2-(4-methylphenyl)-1H-indole?
7-fluoro-5-methyl-2-(4-methylphenyl)-1H-indole has a molecular weight of 239.29 g/mol, XLogP of 4.59, 1 rotatable bonds, 1 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 7-fluoro-5-methyl-2-(4-methylphenyl)-1H-indole is sourced from PubChem (CID 156815950), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).