(2-fluoro-3-methylphenyl)-thiophen-2-ylmethanol

C12H11FOS — CID 81477693

IUPAC(2-fluoro-3-methylphenyl)-thiophen-2-ylmethanol
SMILESCc1cccc(C(O)c2cccs2)c1F
InChIInChI=1S/C12H11FOS/c1-8-4-2-5-9(11(8)13)12(14)10-6-3-7-15-10/h2-7,12,14H,1H3
InChIKeyCFGUAHRZYZMQGZ-UHFFFAOYSA-N
MW222.28 g/mol
LogP3.28
Rot. Bonds2

About (2-fluoro-3-methylphenyl)-thiophen-2-ylmethanol

(2-fluoro-3-methylphenyl)-thiophen-2-ylmethanol (PubChem CID 81477693) has the molecular formula C12H11FOS and a molecular weight of 222.28 g/mol. Its IUPAC name is (2-fluoro-3-methylphenyl)-thiophen-2-ylmethanol.

Molecular Properties

Compound Name(2-fluoro-3-methylphenyl)-thiophen-2-ylmethanol
PubChem CID81477693
Molecular FormulaC12H11FOS
Molecular Weight222.28 g/mol
Exact Mass222.05
IUPAC Name(2-fluoro-3-methylphenyl)-thiophen-2-ylmethanol
SMILESCc1cccc(C(O)c2cccs2)c1F
InChIInChI=1S/C12H11FOS/c1-8-4-2-5-9(11(8)13)12(14)10-6-3-7-15-10/h2-7,12,14H,1H3
InChIKeyCFGUAHRZYZMQGZ-UHFFFAOYSA-N
XLogP3.28
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.28
LogP ≤ 53.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(2-fluoro-3-methylphenyl)-2-thiophen-2-ylethanol
CID 81477466
(3-bromo-2-fluorophenyl)-(2-fluoro-3-methylphenyl)methanol
CID 106648481
(2-fluoro-3-methylphenyl)-(3-fluorophenyl)methanol
CID 114978614
(4-chlorophenyl)-(2-fluoro-3-methylphenyl)methanol
CID 81477274
2-[bis(2-methylphenyl)methyl]thiophene
CID 70541679
(2-fluoro-3-methylphenyl)-pyrimidin-5-ylmethanol
CID 115781644
(2,6-dimethoxyphenyl)-(2-fluoro-3-methylphenyl)methanol
CID 115838581
(3,4-difluorophenyl)-(2-fluoro-3-methylphenyl)methanol
CID 81477927
(2-fluoro-3-methylphenyl)-(3-fluoro-5-methylphenyl)methanol
CID 115823134
1-(2-fluoro-3-methylphenyl)propan-1-ol
CID 115787793
1-(2-fluoro-3-methylphenyl)-N-methyl-2-thiophen-2-ylethanamine
CID 81477797
(1S)-1-amino-1-(2-fluoro-3-methylphenyl)propan-2-ol
CID 131081645

Frequently Asked Questions

What is the IUPAC name of (2-fluoro-3-methylphenyl)-thiophen-2-ylmethanol?
The IUPAC name of (2-fluoro-3-methylphenyl)-thiophen-2-ylmethanol (CID 81477693) is (2-fluoro-3-methylphenyl)-thiophen-2-ylmethanol.
What is the SMILES notation for (2-fluoro-3-methylphenyl)-thiophen-2-ylmethanol?
The canonical SMILES for (2-fluoro-3-methylphenyl)-thiophen-2-ylmethanol is Cc1cccc(C(O)c2cccs2)c1F.
What is the InChIKey of (2-fluoro-3-methylphenyl)-thiophen-2-ylmethanol?
The InChIKey is CFGUAHRZYZMQGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11FOS/c1-8-4-2-5-9(11(8)13)12(14)10-6-3-7-15-10/h2-7,12,14H,1H3.
What are the key properties of (2-fluoro-3-methylphenyl)-thiophen-2-ylmethanol?
(2-fluoro-3-methylphenyl)-thiophen-2-ylmethanol has a molecular weight of 222.28 g/mol, XLogP of 3.28, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2-fluoro-3-methylphenyl)-thiophen-2-ylmethanol is sourced from PubChem (CID 81477693), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).