7-(2-cyclohexylethoxy)-5-fluoro-1H-indole

C16H20FNO — CID 175867004

IUPAC7-(2-cyclohexylethoxy)-5-fluoro-1H-indole
SMILESFc1cc(OCCC2CCCCC2)c2[nH]ccc2c1
InChIInChI=1S/C16H20FNO/c17-14-10-13-6-8-18-16(13)15(11-14)19-9-7-12-4-2-1-3-5-12/h6,8,10-12,18H,1-5,7,9H2
InChIKeyQPGPXOHUNLQNIL-UHFFFAOYSA-N
MW261.34 g/mol
LogP4.66
Rot. Bonds4

About 7-(2-cyclohexylethoxy)-5-fluoro-1H-indole

7-(2-cyclohexylethoxy)-5-fluoro-1H-indole (PubChem CID 175867004) has the molecular formula C16H20FNO and a molecular weight of 261.34 g/mol. Its IUPAC name is 7-(2-cyclohexylethoxy)-5-fluoro-1H-indole.

Molecular Properties

Compound Name7-(2-cyclohexylethoxy)-5-fluoro-1H-indole
PubChem CID175867004
Molecular FormulaC16H20FNO
Molecular Weight261.34 g/mol
Exact Mass261.15
IUPAC Name7-(2-cyclohexylethoxy)-5-fluoro-1H-indole
SMILESFc1cc(OCCC2CCCCC2)c2[nH]ccc2c1
InChIInChI=1S/C16H20FNO/c17-14-10-13-6-8-18-16(13)15(11-14)19-9-7-12-4-2-1-3-5-12/h6,8,10-12,18H,1-5,7,9H2
InChIKeyQPGPXOHUNLQNIL-UHFFFAOYSA-N
XLogP4.66
TPSA25.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.34
LogP ≤ 54.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-(chloromethyl)-1-(2-cyclohexylethoxy)-4-fluorobenzene
CID 114191447
1-(2-cyclohexylethoxy)-2-iodobenzene
CID 155907429
[2-(2-cyclobutylethoxy)-5-fluorophenyl]methanamine
CID 106199490
[4-(2-cyclohexylethoxy)-3-fluorophenyl]methanol
CID 114191393
1-(2-cyclopentylethoxy)-4,5-difluoro-2-methylbenzene
CID 114276820
4-(2-cyclohexylethoxy)-3-methylaniline
CID 26189992
1,4-dichloro-2-(2-cyclohexylethoxy)benzene
CID 114193047
1-(cyclobutylmethoxy)-4-(2-cyclopentylethoxy)-3-fluoro-2-methylbenzene
CID 158334858
2-(2-cyclobutylethoxy)-5-fluorobenzonitrile
CID 106201555
2-(2-cyclobutylethoxy)-5-iodoaniline
CID 106199721
4-(2-cyclobutylethoxy)-3-(trifluoromethyl)aniline
CID 106199812
[4-(2-cyclohexylethoxy)-2-fluorophenyl]borane
CID 88897052

Frequently Asked Questions

What is the IUPAC name of 7-(2-cyclohexylethoxy)-5-fluoro-1H-indole?
The IUPAC name of 7-(2-cyclohexylethoxy)-5-fluoro-1H-indole (CID 175867004) is 7-(2-cyclohexylethoxy)-5-fluoro-1H-indole.
What is the SMILES notation for 7-(2-cyclohexylethoxy)-5-fluoro-1H-indole?
The canonical SMILES for 7-(2-cyclohexylethoxy)-5-fluoro-1H-indole is Fc1cc(OCCC2CCCCC2)c2[nH]ccc2c1.
What is the InChIKey of 7-(2-cyclohexylethoxy)-5-fluoro-1H-indole?
The InChIKey is QPGPXOHUNLQNIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20FNO/c17-14-10-13-6-8-18-16(13)15(11-14)19-9-7-12-4-2-1-3-5-12/h6,8,10-12,18H,1-5,7,9H2.
What are the key properties of 7-(2-cyclohexylethoxy)-5-fluoro-1H-indole?
7-(2-cyclohexylethoxy)-5-fluoro-1H-indole has a molecular weight of 261.34 g/mol, XLogP of 4.66, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(2-cyclohexylethoxy)-5-fluoro-1H-indole is sourced from PubChem (CID 175867004), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).