(5-methylthiophen-2-yl)-(5-methylthiophen-3-yl)methanol

C11H12OS2 — CID 65099731

IUPAC(5-methylthiophen-2-yl)-(5-methylthiophen-3-yl)methanol
SMILESCc1cc(C(O)c2ccc(C)s2)cs1
InChIInChI=1S/C11H12OS2/c1-7-3-4-10(14-7)11(12)9-5-8(2)13-6-9/h3-6,11-12H,1-2H3
InChIKeyNBMRAEWSTPBLKR-UHFFFAOYSA-N
MW224.35 g/mol
LogP3.51
Rot. Bonds2

About (5-methylthiophen-2-yl)-(5-methylthiophen-3-yl)methanol

(5-methylthiophen-2-yl)-(5-methylthiophen-3-yl)methanol (PubChem CID 65099731) has the molecular formula C11H12OS2 and a molecular weight of 224.35 g/mol. Its IUPAC name is (5-methylthiophen-2-yl)-(5-methylthiophen-3-yl)methanol.

Molecular Properties

Compound Name(5-methylthiophen-2-yl)-(5-methylthiophen-3-yl)methanol
PubChem CID65099731
Molecular FormulaC11H12OS2
Molecular Weight224.35 g/mol
Exact Mass224.03
IUPAC Name(5-methylthiophen-2-yl)-(5-methylthiophen-3-yl)methanol
SMILESCc1cc(C(O)c2ccc(C)s2)cs1
InChIInChI=1S/C11H12OS2/c1-7-3-4-10(14-7)11(12)9-5-8(2)13-6-9/h3-6,11-12H,1-2H3
InChIKeyNBMRAEWSTPBLKR-UHFFFAOYSA-N
XLogP3.51
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.35
LogP ≤ 53.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-1-(5-methylthiophen-2-yl)-1-(5-methylthiophen-3-yl)methanamine
CID 104991248
(5-methylthiophen-3-yl)-thieno[3,2-b]thiophen-5-ylmethanol
CID 115807767
[(5-methylthiophen-2-yl)-(5-methylthiophen-3-yl)methyl]hydrazine
CID 105313203
(3,4-dimethylphenyl)-(5-methylthiophen-3-yl)methanol
CID 65100079
(3-methylphenyl)-(5-methylthiophen-3-yl)methanol
CID 65099789
(S)-(4-methoxyphenyl)-(5-methylthiophen-2-yl)methanol
CID 40535084
(1R)-1-(5-methylthiophen-3-yl)ethanol
CID 131209035
(5-methylthiophen-3-yl)-(2,4,6-trimethylphenyl)methanol
CID 65099676
(3,5-dichlorophenyl)-(5-methylthiophen-3-yl)methanol
CID 65099738
(S)-(3-chloro-4-fluorophenyl)-(5-methylthiophen-2-yl)methanol
CID 97001534
(2-methyl-4-pyridinyl)-(5-methylthiophen-3-yl)methanol
CID 106756231
(4-cyclopropylphenyl)-(5-methylthiophen-2-yl)methanol
CID 79980013

Frequently Asked Questions

What is the IUPAC name of (5-methylthiophen-2-yl)-(5-methylthiophen-3-yl)methanol?
The IUPAC name of (5-methylthiophen-2-yl)-(5-methylthiophen-3-yl)methanol (CID 65099731) is (5-methylthiophen-2-yl)-(5-methylthiophen-3-yl)methanol.
What is the SMILES notation for (5-methylthiophen-2-yl)-(5-methylthiophen-3-yl)methanol?
The canonical SMILES for (5-methylthiophen-2-yl)-(5-methylthiophen-3-yl)methanol is Cc1cc(C(O)c2ccc(C)s2)cs1.
What is the InChIKey of (5-methylthiophen-2-yl)-(5-methylthiophen-3-yl)methanol?
The InChIKey is NBMRAEWSTPBLKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12OS2/c1-7-3-4-10(14-7)11(12)9-5-8(2)13-6-9/h3-6,11-12H,1-2H3.
What are the key properties of (5-methylthiophen-2-yl)-(5-methylthiophen-3-yl)methanol?
(5-methylthiophen-2-yl)-(5-methylthiophen-3-yl)methanol has a molecular weight of 224.35 g/mol, XLogP of 3.51, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5-methylthiophen-2-yl)-(5-methylthiophen-3-yl)methanol is sourced from PubChem (CID 65099731), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).