5-fluoro-2-methyl-2H-indole

C9H8FN — CID 173150045

IUPAC5-fluoro-2-methyl-2H-indole
SMILESCC1C=C2C=C(C=CC2=N1)F
InChIInChI=1S/C9H8FN/c1-6-4-7-5-8(10)2-3-9(7)11-6/h2-6H,1H3
InChIKeyWTWBLGOXEWSBDJ-UHFFFAOYSA-N
MW149.16 g/mol
LogP1.50
Rot. Bonds

About 5-fluoro-2-methyl-2H-indole

5-fluoro-2-methyl-2H-indole (PubChem CID 173150045) has the molecular formula C9H8FN and a molecular weight of 149.16 g/mol. Its IUPAC name is 5-fluoro-2-methyl-2H-indole.

Molecular Properties

Compound Name5-fluoro-2-methyl-2H-indole
PubChem CID173150045
Molecular FormulaC9H8FN
Molecular Weight149.16 g/mol
Exact Mass149.06
IUPAC Name5-fluoro-2-methyl-2H-indole
SMILESCC1C=C2C=C(C=CC2=N1)F
InChIInChI=1S/C9H8FN/c1-6-4-7-5-8(10)2-3-9(7)11-6/h2-6H,1H3
InChIKeyWTWBLGOXEWSBDJ-UHFFFAOYSA-N
XLogP1.50
TPSA12.40 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity308

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500149.16
LogP ≤ 51.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

8aH-carbazole
CID 9548747
7-Fluorotetrahydrocyclopenta[b]indole
CID 129744738
2H-Indole
CID 19013146
2-Methylindol-2-ylium
CID 57054412
2-methyl-2H-indole
CID 58371059
Trimethyl 2h indol
CID 101318478
2-fluoro-N-prop-2-enylcyclohexa-2,4-dien-1-imine
CID 67831161
(2S)-6-(2-fluoroethyl)-2-methyl-2,3-dihydropyridine
CID 67991646
5-fluoro-2H-indole
CID 69725021
2-fluoro-2H-indole
CID 69725022
(3Z)-3-[(2Z)-4-fluoropenta-2,4-dienylidene]-6-methyl-2H-pyridine
CID 90145839
7-Fluoro-3-methyl-2-prop-1-enyl-2,3-dihydroquinoline
CID 91172116

Frequently Asked Questions

What is the IUPAC name of 5-fluoro-2-methyl-2H-indole?
The IUPAC name of 5-fluoro-2-methyl-2H-indole (CID 173150045) is 5-fluoro-2-methyl-2H-indole.
What is the SMILES notation for 5-fluoro-2-methyl-2H-indole?
The canonical SMILES for 5-fluoro-2-methyl-2H-indole is CC1C=C2C=C(C=CC2=N1)F.
What is the InChIKey of 5-fluoro-2-methyl-2H-indole?
The InChIKey is WTWBLGOXEWSBDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8FN/c1-6-4-7-5-8(10)2-3-9(7)11-6/h2-6H,1H3.
What are the key properties of 5-fluoro-2-methyl-2H-indole?
5-fluoro-2-methyl-2H-indole has a molecular weight of 149.16 g/mol, XLogP of 1.50, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-2-methyl-2H-indole is sourced from PubChem (CID 173150045), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).