2-[4-(4-ethylphenyl)-2-fluorophenyl]thiophene

C18H15FS — CID 143775701

IUPAC2-[4-(4-ethylphenyl)-2-fluorophenyl]thiophene
SMILESCCc1ccc(-c2ccc(-c3cccs3)c(F)c2)cc1
InChIInChI=1S/C18H15FS/c1-2-13-5-7-14(8-6-13)15-9-10-16(17(19)12-15)18-4-3-11-20-18/h3-12H,2H2,1H3
InChIKeyFIAKXMCTJSFAIY-UHFFFAOYSA-N
MW282.38 g/mol
LogP5.78
Rot. Bonds3

About 2-[4-(4-ethylphenyl)-2-fluorophenyl]thiophene

2-[4-(4-ethylphenyl)-2-fluorophenyl]thiophene (PubChem CID 143775701) has the molecular formula C18H15FS and a molecular weight of 282.38 g/mol. Its IUPAC name is 2-[4-(4-ethylphenyl)-2-fluorophenyl]thiophene.

Molecular Properties

Compound Name2-[4-(4-ethylphenyl)-2-fluorophenyl]thiophene
PubChem CID143775701
Molecular FormulaC18H15FS
Molecular Weight282.38 g/mol
Exact Mass282.09
IUPAC Name2-[4-(4-ethylphenyl)-2-fluorophenyl]thiophene
SMILESCCc1ccc(-c2ccc(-c3cccs3)c(F)c2)cc1
InChIInChI=1S/C18H15FS/c1-2-13-5-7-14(8-6-13)15-9-10-16(17(19)12-15)18-4-3-11-20-18/h3-12H,2H2,1H3
InChIKeyFIAKXMCTJSFAIY-UHFFFAOYSA-N
XLogP5.78
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500282.38
LogP ≤ 55.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

4-ethyl-1-[4-(4-ethylphenyl)phenyl]-2-fluorobenzene
CID 129263989
4-(4-ethylphenyl)-1-(4-ethynylphenyl)-2-fluorobenzene
CID 140891747
2-(2-cyclopropylethyl)-5-[4-(4-ethylphenyl)-2-fluorophenyl]thiophene
CID 166999874
1-(4-butylphenyl)-4-(4-ethylphenyl)-2-fluorobenzene;4-(4-ethylphenyl)-2-fluoro-1-(4-propylphenyl)benzene
CID 161123973
4-[4-[2-(4-ethylphenyl)ethyl]phenyl]-1,2-difluorobenzene
CID 18984130
1-(4-ethylphenyl)-2-fluoro-4-(2-fluoro-4-methylphenyl)benzene
CID 169027138
2-(5-ethyl-2-methoxyphenyl)thiophene
CID 20651347
2-fluoro-5-[2-fluoro-4-(4-propylphenyl)phenyl]thiophene
CID 58160698
[4-[4-(4-ethylphenyl)-3-fluorophenyl]-3-fluorophenyl]phosphane
CID 170132292
1-(4-ethylphenyl)-2-fluoro-4-(4-pent-3-enylphenyl)benzene
CID 76678385
1,4-bis(4-butylphenyl)-2-fluorobenzene;1-(4-butylphenyl)-2-fluoro-4-(4-pentylphenyl)benzene;4-(4-butylphenyl)-2-fluoro-1-(4-pentylphenyl)benzene;1-(4-ethylphenyl)-2-fluoro-4-(4-pentylphenyl)benzene;2-fluoro-1,4-bis(4-pentylphenyl)benzene;2-fluoro-4-(4-pentylphenyl)-1-(4-propylphenyl)benzene
CID 167612803
1-(difluoromethoxy)-4-[4-(4-ethylphenyl)-2-fluorophenyl]-2-fluorobenzene
CID 67798587

Frequently Asked Questions

What is the IUPAC name of 2-[4-(4-ethylphenyl)-2-fluorophenyl]thiophene?
The IUPAC name of 2-[4-(4-ethylphenyl)-2-fluorophenyl]thiophene (CID 143775701) is 2-[4-(4-ethylphenyl)-2-fluorophenyl]thiophene.
What is the SMILES notation for 2-[4-(4-ethylphenyl)-2-fluorophenyl]thiophene?
The canonical SMILES for 2-[4-(4-ethylphenyl)-2-fluorophenyl]thiophene is CCc1ccc(-c2ccc(-c3cccs3)c(F)c2)cc1.
What is the InChIKey of 2-[4-(4-ethylphenyl)-2-fluorophenyl]thiophene?
The InChIKey is FIAKXMCTJSFAIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15FS/c1-2-13-5-7-14(8-6-13)15-9-10-16(17(19)12-15)18-4-3-11-20-18/h3-12H,2H2,1H3.
What are the key properties of 2-[4-(4-ethylphenyl)-2-fluorophenyl]thiophene?
2-[4-(4-ethylphenyl)-2-fluorophenyl]thiophene has a molecular weight of 282.38 g/mol, XLogP of 5.78, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(4-ethylphenyl)-2-fluorophenyl]thiophene is sourced from PubChem (CID 143775701), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).