5-fluoro-2-methylideneindole

C9H6FN — CID 123585888

IUPAC5-fluoro-2-methylideneindole
SMILESC=C1C=c2cc(F)ccc2=N1
InChIInChI=1S/C9H6FN/c1-6-4-7-5-8(10)2-3-9(7)11-6/h2-5H,1H2
InChIKeyWFDPDRAZUMKYSK-UHFFFAOYSA-N
MW147.15 g/mol
LogP0.75
Rot. Bonds

About 5-fluoro-2-methylideneindole

5-fluoro-2-methylideneindole (PubChem CID 123585888) has the molecular formula C9H6FN and a molecular weight of 147.15 g/mol. Its IUPAC name is 5-fluoro-2-methylideneindole.

Molecular Properties

Compound Name5-fluoro-2-methylideneindole
PubChem CID123585888
Molecular FormulaC9H6FN
Molecular Weight147.15 g/mol
Exact Mass147.05
IUPAC Name5-fluoro-2-methylideneindole
SMILESC=C1C=c2cc(F)ccc2=N1
InChIInChI=1S/C9H6FN/c1-6-4-7-5-8(10)2-3-9(7)11-6/h2-5H,1H2
InChIKeyWFDPDRAZUMKYSK-UHFFFAOYSA-N
XLogP0.75
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500147.15
LogP ≤ 50.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2H-Indole
CID 19013146
4H-Carbazole
CID 19360791
2H-carbazole
CID 19830578
Methyleneindole
CID 20077160
5H-Indole
CID 20712154
Cyclopentacarbazole
CID 21887528
2-Methylindol-2-ylium
CID 57054412
2-Methylideneindol-1-ium
CID 59596733
3a-Fluoro-2-methylindole
CID 68281758
5-fluoro-2H-indole
CID 69725021
2-fluoro-2H-indole
CID 69725022
5-fluoro-7H-indole
CID 97295149

Frequently Asked Questions

What is the IUPAC name of 5-fluoro-2-methylideneindole?
The IUPAC name of 5-fluoro-2-methylideneindole (CID 123585888) is 5-fluoro-2-methylideneindole.
What is the SMILES notation for 5-fluoro-2-methylideneindole?
The canonical SMILES for 5-fluoro-2-methylideneindole is C=C1C=c2cc(F)ccc2=N1.
What is the InChIKey of 5-fluoro-2-methylideneindole?
The InChIKey is WFDPDRAZUMKYSK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H6FN/c1-6-4-7-5-8(10)2-3-9(7)11-6/h2-5H,1H2.
What are the key properties of 5-fluoro-2-methylideneindole?
5-fluoro-2-methylideneindole has a molecular weight of 147.15 g/mol, XLogP of 0.75, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-2-methylideneindole is sourced from PubChem (CID 123585888), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).