1-(3-fluorophenyl)-2-thiophen-3-ylethanol

C12H11FOS — CID 62607958

IUPAC1-(3-fluorophenyl)-2-thiophen-3-ylethanol
SMILESOC(Cc1ccsc1)c1cccc(F)c1
InChIInChI=1S/C12H11FOS/c13-11-3-1-2-10(7-11)12(14)6-9-4-5-15-8-9/h1-5,7-8,12,14H,6H2
InChIKeyUCZHSUDHVXKBBR-UHFFFAOYSA-N
MW222.28 g/mol
LogP3.16
Rot. Bonds3

About 1-(3-fluorophenyl)-2-thiophen-3-ylethanol

1-(3-fluorophenyl)-2-thiophen-3-ylethanol (PubChem CID 62607958) has the molecular formula C12H11FOS and a molecular weight of 222.28 g/mol. Its IUPAC name is 1-(3-fluorophenyl)-2-thiophen-3-ylethanol.

Molecular Properties

Compound Name1-(3-fluorophenyl)-2-thiophen-3-ylethanol
PubChem CID62607958
Molecular FormulaC12H11FOS
Molecular Weight222.28 g/mol
Exact Mass222.05
IUPAC Name1-(3-fluorophenyl)-2-thiophen-3-ylethanol
SMILESOC(Cc1ccsc1)c1cccc(F)c1
InChIInChI=1S/C12H11FOS/c13-11-3-1-2-10(7-11)12(14)6-9-4-5-15-8-9/h1-5,7-8,12,14H,6H2
InChIKeyUCZHSUDHVXKBBR-UHFFFAOYSA-N
XLogP3.16
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.28
LogP ≤ 53.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-ethyl-1-(3-fluorophenyl)-2-thiophen-3-ylethanamine
CID 61078915
1-(3-phenoxyphenyl)-2-thiophen-3-ylethanol
CID 65148023
1-(3-bromo-4-fluorophenyl)-2-thiophen-3-ylethanol
CID 65148445
1-(3-chloro-4-fluorophenyl)-2-thiophen-3-ylethanol
CID 63094329
2-[(3-fluorophenyl)methyl]-3-thiophen-3-ylpropan-1-ol
CID 66059493
2-(3-fluorophenyl)-4-thiophen-3-ylbutan-1-ol
CID 79443461
N-[1-(3-fluorophenyl)-2-thiophen-3-ylethyl]propan-1-amine
CID 61078925
1-(4-bromo-3-methylphenyl)-2-thiophen-3-ylethanol
CID 81446687
2-(3,5-difluorophenyl)-1-thiophen-3-ylethanol
CID 65099650
1-(3-fluorophenyl)-2-(furan-3-yl)ethanol
CID 83171476
3-[2-chloro-2-(3,5-difluorophenyl)ethyl]thiophene
CID 63016253
1-(3-chlorophenyl)-2-(3-fluorophenyl)ethanol
CID 60798270

Frequently Asked Questions

What is the IUPAC name of 1-(3-fluorophenyl)-2-thiophen-3-ylethanol?
The IUPAC name of 1-(3-fluorophenyl)-2-thiophen-3-ylethanol (CID 62607958) is 1-(3-fluorophenyl)-2-thiophen-3-ylethanol.
What is the SMILES notation for 1-(3-fluorophenyl)-2-thiophen-3-ylethanol?
The canonical SMILES for 1-(3-fluorophenyl)-2-thiophen-3-ylethanol is OC(Cc1ccsc1)c1cccc(F)c1.
What is the InChIKey of 1-(3-fluorophenyl)-2-thiophen-3-ylethanol?
The InChIKey is UCZHSUDHVXKBBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11FOS/c13-11-3-1-2-10(7-11)12(14)6-9-4-5-15-8-9/h1-5,7-8,12,14H,6H2.
What are the key properties of 1-(3-fluorophenyl)-2-thiophen-3-ylethanol?
1-(3-fluorophenyl)-2-thiophen-3-ylethanol has a molecular weight of 222.28 g/mol, XLogP of 3.16, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-fluorophenyl)-2-thiophen-3-ylethanol is sourced from PubChem (CID 62607958), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).