(2-methylthiophen-3-yl)-(1,2-thiazol-3-yl)methanol

C9H9NOS2 — CID 130631086

IUPAC(2-methylthiophen-3-yl)-(1,2-thiazol-3-yl)methanol
SMILESCc1sccc1C(O)c1ccsn1
InChIInChI=1S/C9H9NOS2/c1-6-7(2-4-12-6)9(11)8-3-5-13-10-8/h2-5,9,11H,1H3
InChIKeyZYGZMISEYZUDQP-UHFFFAOYSA-N
MW211.31 g/mol
LogP2.59
Rot. Bonds2

About (2-methylthiophen-3-yl)-(1,2-thiazol-3-yl)methanol

(2-methylthiophen-3-yl)-(1,2-thiazol-3-yl)methanol (PubChem CID 130631086) has the molecular formula C9H9NOS2 and a molecular weight of 211.31 g/mol. Its IUPAC name is (2-methylthiophen-3-yl)-(1,2-thiazol-3-yl)methanol.

Molecular Properties

Compound Name(2-methylthiophen-3-yl)-(1,2-thiazol-3-yl)methanol
PubChem CID130631086
Molecular FormulaC9H9NOS2
Molecular Weight211.31 g/mol
Exact Mass211.01
IUPAC Name(2-methylthiophen-3-yl)-(1,2-thiazol-3-yl)methanol
SMILESCc1sccc1C(O)c1ccsn1
InChIInChI=1S/C9H9NOS2/c1-6-7(2-4-12-6)9(11)8-3-5-13-10-8/h2-5,9,11H,1H3
InChIKeyZYGZMISEYZUDQP-UHFFFAOYSA-N
XLogP2.59
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.31
LogP ≤ 52.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

Isothiazolylphenylmethanol
CID 129752610
(3-Fluorothiophen-2-yl)-(3-methyl-1,2-thiazol-5-yl)methanol
CID 130653495
(4-Fluorophenyl)-(1,2-thiazol-3-yl)methanol
CID 130731393
(3-Thiophen-3-yl-1,2-thiazol-5-yl)methanol
CID 19744568
(2-Methylthiophen-3-yl)-(thiadiazol-4-yl)methanol
CID 102842253
(4-Methylthiadiazol-5-yl)-(2-methylthiophen-3-yl)methanol
CID 102842557
(5-Methylthiophen-3-yl)-(thiadiazol-4-yl)methanol
CID 105103889
(3-Methylthiophen-2-yl)-(thiadiazol-4-yl)methanol
CID 105112987
1-(1,2-Thiazol-3-yl)-1-thiophen-3-ylethanol
CID 127003876
2-Phenyl-1-(1,2-thiazol-3-yl)ethanol
CID 130604788
(3-Methyl-1,2-thiazol-5-yl)-(2-methylthiophen-3-yl)methanol
CID 130604946
(2-Chlorothiophen-3-yl)-(1,2-thiazol-3-yl)methanol
CID 130606658

Frequently Asked Questions

What is the IUPAC name of (2-methylthiophen-3-yl)-(1,2-thiazol-3-yl)methanol?
The IUPAC name of (2-methylthiophen-3-yl)-(1,2-thiazol-3-yl)methanol (CID 130631086) is (2-methylthiophen-3-yl)-(1,2-thiazol-3-yl)methanol.
What is the SMILES notation for (2-methylthiophen-3-yl)-(1,2-thiazol-3-yl)methanol?
The canonical SMILES for (2-methylthiophen-3-yl)-(1,2-thiazol-3-yl)methanol is Cc1sccc1C(O)c1ccsn1.
What is the InChIKey of (2-methylthiophen-3-yl)-(1,2-thiazol-3-yl)methanol?
The InChIKey is ZYGZMISEYZUDQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9NOS2/c1-6-7(2-4-12-6)9(11)8-3-5-13-10-8/h2-5,9,11H,1H3.
What are the key properties of (2-methylthiophen-3-yl)-(1,2-thiazol-3-yl)methanol?
(2-methylthiophen-3-yl)-(1,2-thiazol-3-yl)methanol has a molecular weight of 211.31 g/mol, XLogP of 2.59, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2-methylthiophen-3-yl)-(1,2-thiazol-3-yl)methanol is sourced from PubChem (CID 130631086), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).