6-fluoro-2-(2-methoxypropan-2-yl)-1H-indole

C12H14FNO — CID 165486244

IUPAC6-fluoro-2-(2-methoxypropan-2-yl)-1H-indole
SMILESCOC(C)(C)c1cc2ccc(F)cc2[nH]1
InChIInChI=1S/C12H14FNO/c1-12(2,15-3)11-6-8-4-5-9(13)7-10(8)14-11/h4-7,14H,1-3H3
InChIKeyUVZQFPSUIPXMOP-UHFFFAOYSA-N
MW207.25 g/mol
LogP3.19
Rot. Bonds2

About 6-fluoro-2-(2-methoxypropan-2-yl)-1H-indole

6-fluoro-2-(2-methoxypropan-2-yl)-1H-indole (PubChem CID 165486244) has the molecular formula C12H14FNO and a molecular weight of 207.25 g/mol. Its IUPAC name is 6-fluoro-2-(2-methoxypropan-2-yl)-1H-indole.

Molecular Properties

Compound Name6-fluoro-2-(2-methoxypropan-2-yl)-1H-indole
PubChem CID165486244
Molecular FormulaC12H14FNO
Molecular Weight207.25 g/mol
Exact Mass207.11
IUPAC Name6-fluoro-2-(2-methoxypropan-2-yl)-1H-indole
SMILESCOC(C)(C)c1cc2ccc(F)cc2[nH]1
InChIInChI=1S/C12H14FNO/c1-12(2,15-3)11-6-8-4-5-9(13)7-10(8)14-11/h4-7,14H,1-3H3
InChIKeyUVZQFPSUIPXMOP-UHFFFAOYSA-N
XLogP3.19
TPSA25.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.25
LogP ≤ 53.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-(1,1-difluoroethyl)-1H-indol-6-amine
CID 84666688
methyl 2-(trifluoromethyl)-1H-indole-6-carboxylate
CID 73425268
N-[(6-fluoro-1H-indol-2-yl)methyl]ethanamine
CID 117180302
2-(2-fluoropropan-2-yl)-1H-indol-6-amine
CID 84664033
2-(4-chlorophenyl)-1-(6-fluoro-1H-indol-2-yl)-2-methylpropan-1-one
CID 11565910
(6-fluoro-1H-indol-2-yl)methanol;methyl 6-fluoro-1H-indole-2-carboxylate
CID 165084433
7-fluoro-1H-quinolin-2-one
CID 19067575
7-fluoro-2-(2-methoxypropan-2-yl)quinolin-3-ol
CID 165476618
sodium;6-fluoro-1H-indole-2-sulfonic acid;hydride
CID 173033196
(6-fluoro-1H-indol-2-yl)-(3,4,5-trimethoxyphenyl)methanone
CID 56646815
3-(1-aminoethyl)-7-fluoro-1H-quinolin-2-one
CID 84620651
3-(6-fluoro-1H-benzimidazol-2-yl)-2,3-dimethylbutan-2-amine
CID 65261564

Frequently Asked Questions

What is the IUPAC name of 6-fluoro-2-(2-methoxypropan-2-yl)-1H-indole?
The IUPAC name of 6-fluoro-2-(2-methoxypropan-2-yl)-1H-indole (CID 165486244) is 6-fluoro-2-(2-methoxypropan-2-yl)-1H-indole.
What is the SMILES notation for 6-fluoro-2-(2-methoxypropan-2-yl)-1H-indole?
The canonical SMILES for 6-fluoro-2-(2-methoxypropan-2-yl)-1H-indole is COC(C)(C)c1cc2ccc(F)cc2[nH]1.
What is the InChIKey of 6-fluoro-2-(2-methoxypropan-2-yl)-1H-indole?
The InChIKey is UVZQFPSUIPXMOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14FNO/c1-12(2,15-3)11-6-8-4-5-9(13)7-10(8)14-11/h4-7,14H,1-3H3.
What are the key properties of 6-fluoro-2-(2-methoxypropan-2-yl)-1H-indole?
6-fluoro-2-(2-methoxypropan-2-yl)-1H-indole has a molecular weight of 207.25 g/mol, XLogP of 3.19, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-fluoro-2-(2-methoxypropan-2-yl)-1H-indole is sourced from PubChem (CID 165486244), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).