1-ethenyl-4-[1-(4-fluorophenyl)cyclohexyl]oxybenzene

C20H21FO — CID 168800151

IUPAC1-ethenyl-4-[1-(4-fluorophenyl)cyclohexyl]oxybenzene
SMILESC=Cc1ccc(OC2(c3ccc(F)cc3)CCCCC2)cc1
InChIInChI=1S/C20H21FO/c1-2-16-6-12-19(13-7-16)22-20(14-4-3-5-15-20)17-8-10-18(21)11-9-17/h2,6-13H,1,3-5,14-15H2
InChIKeyDUEZYPKWWMWSRL-UHFFFAOYSA-N
MW296.39 g/mol
LogP5.71
Rot. Bonds4

About 1-ethenyl-4-[1-(4-fluorophenyl)cyclohexyl]oxybenzene

1-ethenyl-4-[1-(4-fluorophenyl)cyclohexyl]oxybenzene (PubChem CID 168800151) has the molecular formula C20H21FO and a molecular weight of 296.39 g/mol. Its IUPAC name is 1-ethenyl-4-[1-(4-fluorophenyl)cyclohexyl]oxybenzene.

Molecular Properties

Compound Name1-ethenyl-4-[1-(4-fluorophenyl)cyclohexyl]oxybenzene
PubChem CID168800151
Molecular FormulaC20H21FO
Molecular Weight296.39 g/mol
Exact Mass296.16
IUPAC Name1-ethenyl-4-[1-(4-fluorophenyl)cyclohexyl]oxybenzene
SMILESC=Cc1ccc(OC2(c3ccc(F)cc3)CCCCC2)cc1
InChIInChI=1S/C20H21FO/c1-2-16-6-12-19(13-7-16)22-20(14-4-3-5-15-20)17-8-10-18(21)11-9-17/h2,6-13H,1,3-5,14-15H2
InChIKeyDUEZYPKWWMWSRL-UHFFFAOYSA-N
XLogP5.71
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500296.39
LogP ≤ 55.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1-ethenyl-4-(1-methylcyclopentyl)oxybenzene
CID 19350374
[1-(4-fluorophenyl)cyclopentyl] 5-ethenyl-2-hydroxybenzoate
CID 164974517
1-(1-ethenylcyclohexyl)-4-fluorobenzene
CID 141324071
ethane;1-ethenyl-4-fluorobenzene
CID 143529924
1-(2-ethenoxyethoxy)-4-[1-(4-ethenylphenyl)cyclohexyl]benzene
CID 21044973
azane;1-fluoro-4-(1-methylcyclopentyl)benzene
CID 174449315
1-ethenyl-4-fluorobenzene;toluene
CID 170790144
1-[4-(4-ethenyl-2,3,5,6-tetrafluorophenoxy)phenyl]-1-[4-[4-[4-[4-[1-[4-(4-ethenyl-2,3,5,6-tetrafluorophenoxy)phenyl]cyclododecyl]phenoxy]-2,3,5,6-tetrafluorophenyl]-2,3,5,6-tetrafluorophenoxy]phenyl]cyclododecane
CID 176646175
4-(1-phenylcyclobutyl)oxybenzonitrile
CID 159749634
1-[1-(4-fluorophenyl)cyclohexyl]-N-methylmethanamine
CID 58954797
2-(4-fluorophenyl)spiro[3.4]octan-2-amine
CID 65002671
[1-(4-fluorophenoxy)cyclopropyl]methanamine
CID 83920748

Frequently Asked Questions

What is the IUPAC name of 1-ethenyl-4-[1-(4-fluorophenyl)cyclohexyl]oxybenzene?
The IUPAC name of 1-ethenyl-4-[1-(4-fluorophenyl)cyclohexyl]oxybenzene (CID 168800151) is 1-ethenyl-4-[1-(4-fluorophenyl)cyclohexyl]oxybenzene.
What is the SMILES notation for 1-ethenyl-4-[1-(4-fluorophenyl)cyclohexyl]oxybenzene?
The canonical SMILES for 1-ethenyl-4-[1-(4-fluorophenyl)cyclohexyl]oxybenzene is C=Cc1ccc(OC2(c3ccc(F)cc3)CCCCC2)cc1.
What is the InChIKey of 1-ethenyl-4-[1-(4-fluorophenyl)cyclohexyl]oxybenzene?
The InChIKey is DUEZYPKWWMWSRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H21FO/c1-2-16-6-12-19(13-7-16)22-20(14-4-3-5-15-20)17-8-10-18(21)11-9-17/h2,6-13H,1,3-5,14-15H2.
What are the key properties of 1-ethenyl-4-[1-(4-fluorophenyl)cyclohexyl]oxybenzene?
1-ethenyl-4-[1-(4-fluorophenyl)cyclohexyl]oxybenzene has a molecular weight of 296.39 g/mol, XLogP of 5.71, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethenyl-4-[1-(4-fluorophenyl)cyclohexyl]oxybenzene is sourced from PubChem (CID 168800151), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).