6-methyl-5-(trifluoromethyl)-5,6-dihydro-1H-indole

C10H10F3N — CID 162583310

IUPAC6-methyl-5-(trifluoromethyl)-5,6-dihydro-1H-indole
SMILESCC1C=c2[nH]ccc2=CC1C(F)(F)F
InChIInChI=1S/C10H10F3N/c1-6-4-9-7(2-3-14-9)5-8(6)10(11,12)13/h2-6,8,14H,1H3
InChIKeyVUIQRVTUWJZQAQ-UHFFFAOYSA-N
MW201.19 g/mol
LogP1.40
Rot. Bonds

About 6-methyl-5-(trifluoromethyl)-5,6-dihydro-1H-indole

6-methyl-5-(trifluoromethyl)-5,6-dihydro-1H-indole (PubChem CID 162583310) has the molecular formula C10H10F3N and a molecular weight of 201.19 g/mol. Its IUPAC name is 6-methyl-5-(trifluoromethyl)-5,6-dihydro-1H-indole.

Molecular Properties

Compound Name6-methyl-5-(trifluoromethyl)-5,6-dihydro-1H-indole
PubChem CID162583310
Molecular FormulaC10H10F3N
Molecular Weight201.19 g/mol
Exact Mass201.08
IUPAC Name6-methyl-5-(trifluoromethyl)-5,6-dihydro-1H-indole
SMILESCC1C=c2[nH]ccc2=CC1C(F)(F)F
InChIInChI=1S/C10H10F3N/c1-6-4-9-7(2-3-14-9)5-8(6)10(11,12)13/h2-6,8,14H,1H3
InChIKeyVUIQRVTUWJZQAQ-UHFFFAOYSA-N
XLogP1.40
TPSA15.79 Ų
H-Bond Donors1
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.19
LogP ≤ 51.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 100

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Related Compounds

5,6-Dihydroindole
CID 57086633
2-[(Z)-1-fluorobut-1-enyl]-3a,7a-dihydro-1H-indole
CID 68403127
5-tert-butyl-2-methylidene-3-(trifluoromethyl)-1H-pyridine
CID 89639552
4-fluoro-5,6-dihydro-1H-indole
CID 123307377
7-fluoro-4-methyl-5,6-dihydro-1H-indole
CID 123444746
5-(difluoromethyl)-N-ethenyl-4-ethylcyclohexa-1,5-dien-1-amine
CID 130321083
(2E,6E)-5,9-difluoro-4,5,7a,11a-tetrahydro-1H-1-benzazonine
CID 135193069
5-fluoro-2-methylidene-3-propan-2-yl-1H-pyridine
CID 138525147
2-ethyl-2-(trifluoromethyl)-1H-pyridine
CID 141379825
N-methyl-1-[4-(trifluoromethyl)cyclohexa-1,5-dien-1-yl]methanamine
CID 142138471
(2Z)-2-(1-fluoro-2-methylprop-2-enylidene)-3-methylidene-1H-pyrrole
CID 145117775
4-(trifluoromethyl)-3a,4-dihydro-1H-indole
CID 146494442

Frequently Asked Questions

What is the IUPAC name of 6-methyl-5-(trifluoromethyl)-5,6-dihydro-1H-indole?
The IUPAC name of 6-methyl-5-(trifluoromethyl)-5,6-dihydro-1H-indole (CID 162583310) is 6-methyl-5-(trifluoromethyl)-5,6-dihydro-1H-indole.
What is the SMILES notation for 6-methyl-5-(trifluoromethyl)-5,6-dihydro-1H-indole?
The canonical SMILES for 6-methyl-5-(trifluoromethyl)-5,6-dihydro-1H-indole is CC1C=c2[nH]ccc2=CC1C(F)(F)F.
What is the InChIKey of 6-methyl-5-(trifluoromethyl)-5,6-dihydro-1H-indole?
The InChIKey is VUIQRVTUWJZQAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10F3N/c1-6-4-9-7(2-3-14-9)5-8(6)10(11,12)13/h2-6,8,14H,1H3.
What are the key properties of 6-methyl-5-(trifluoromethyl)-5,6-dihydro-1H-indole?
6-methyl-5-(trifluoromethyl)-5,6-dihydro-1H-indole has a molecular weight of 201.19 g/mol, XLogP of 1.40, 0 rotatable bonds, 1 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-5-(trifluoromethyl)-5,6-dihydro-1H-indole is sourced from PubChem (CID 162583310), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).