1-(3-fluorophenyl)-1-(5-methylthiophen-3-yl)propan-1-ol

C14H15FOS — CID 114872384

IUPAC1-(3-fluorophenyl)-1-(5-methylthiophen-3-yl)propan-1-ol
SMILESCCC(O)(c1cccc(F)c1)c1csc(C)c1
InChIInChI=1S/C14H15FOS/c1-3-14(16,12-7-10(2)17-9-12)11-5-4-6-13(15)8-11/h4-9,16H,3H2,1-2H3
InChIKeyXXVWUOIXNZBDAB-UHFFFAOYSA-N
MW250.34 g/mol
LogP3.84
Rot. Bonds3

About 1-(3-fluorophenyl)-1-(5-methylthiophen-3-yl)propan-1-ol

1-(3-fluorophenyl)-1-(5-methylthiophen-3-yl)propan-1-ol (PubChem CID 114872384) has the molecular formula C14H15FOS and a molecular weight of 250.34 g/mol. Its IUPAC name is 1-(3-fluorophenyl)-1-(5-methylthiophen-3-yl)propan-1-ol.

Molecular Properties

Compound Name1-(3-fluorophenyl)-1-(5-methylthiophen-3-yl)propan-1-ol
PubChem CID114872384
Molecular FormulaC14H15FOS
Molecular Weight250.34 g/mol
Exact Mass250.08
IUPAC Name1-(3-fluorophenyl)-1-(5-methylthiophen-3-yl)propan-1-ol
SMILESCCC(O)(c1cccc(F)c1)c1csc(C)c1
InChIInChI=1S/C14H15FOS/c1-3-14(16,12-7-10(2)17-9-12)11-5-4-6-13(15)8-11/h4-9,16H,3H2,1-2H3
InChIKeyXXVWUOIXNZBDAB-UHFFFAOYSA-N
XLogP3.84
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.34
LogP ≤ 53.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-Benzothiophen-3-ylmethanol
CID 2776342
Phenyl(2-thienyl)methanol
CID 2741016
2-fluoro-6-methyl-4-[(E)-2-thiophen-2-ylethenyl]phenol
CID 14771894
Diphenyl(thiophen-2-yl)methanol
CID 315631
4-(Thiophen-3-yl)phenol
CID 4130342
4-[(Thiophen-2-yl)methyl]phenol
CID 605440
1,1,1,3,3,3-Hexafluoro-2-(4-thiophen-2-ylphenyl)propan-2-ol
CID 102004321
Cyclopropyl(4-fluorophenyl)thiophen-2-ylmethanol
CID 285500
Diphenyl(thiophen-3-yl)methanol
CID 315629
2-Thiophen-2-ylpent-4-en-2-ol
CID 11229020
Uxwxnuleokqdqj-uhfffaoysa-
CID 21680490
{4-[2-(4-Fluoro-phenyl)-thiophen-3-yl]-phenyl}-methanol
CID 10424013

Frequently Asked Questions

What is the IUPAC name of 1-(3-fluorophenyl)-1-(5-methylthiophen-3-yl)propan-1-ol?
The IUPAC name of 1-(3-fluorophenyl)-1-(5-methylthiophen-3-yl)propan-1-ol (CID 114872384) is 1-(3-fluorophenyl)-1-(5-methylthiophen-3-yl)propan-1-ol.
What is the SMILES notation for 1-(3-fluorophenyl)-1-(5-methylthiophen-3-yl)propan-1-ol?
The canonical SMILES for 1-(3-fluorophenyl)-1-(5-methylthiophen-3-yl)propan-1-ol is CCC(O)(c1cccc(F)c1)c1csc(C)c1.
What is the InChIKey of 1-(3-fluorophenyl)-1-(5-methylthiophen-3-yl)propan-1-ol?
The InChIKey is XXVWUOIXNZBDAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15FOS/c1-3-14(16,12-7-10(2)17-9-12)11-5-4-6-13(15)8-11/h4-9,16H,3H2,1-2H3.
What are the key properties of 1-(3-fluorophenyl)-1-(5-methylthiophen-3-yl)propan-1-ol?
1-(3-fluorophenyl)-1-(5-methylthiophen-3-yl)propan-1-ol has a molecular weight of 250.34 g/mol, XLogP of 3.84, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-fluorophenyl)-1-(5-methylthiophen-3-yl)propan-1-ol is sourced from PubChem (CID 114872384), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).