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

C8H8N2OS2 — CID 102842463

IUPAC(2-methylthiophen-3-yl)-(thiadiazol-5-yl)methanol
SMILESCc1sccc1C(O)c1cnns1
InChIInChI=1S/C8H8N2OS2/c1-5-6(2-3-12-5)8(11)7-4-9-10-13-7/h2-4,8,11H,1H3
InChIKeyXDOKCSBZXWHRDC-UHFFFAOYSA-N
MW212.30 g/mol
LogP1.99
Rot. Bonds2

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

(2-methylthiophen-3-yl)-(thiadiazol-5-yl)methanol (PubChem CID 102842463) has the molecular formula C8H8N2OS2 and a molecular weight of 212.30 g/mol. Its IUPAC name is (2-methylthiophen-3-yl)-(thiadiazol-5-yl)methanol.

Molecular Properties

Compound Name(2-methylthiophen-3-yl)-(thiadiazol-5-yl)methanol
PubChem CID102842463
Molecular FormulaC8H8N2OS2
Molecular Weight212.30 g/mol
Exact Mass212.01
IUPAC Name(2-methylthiophen-3-yl)-(thiadiazol-5-yl)methanol
SMILESCc1sccc1C(O)c1cnns1
InChIInChI=1S/C8H8N2OS2/c1-5-6(2-3-12-5)8(11)7-4-9-10-13-7/h2-4,8,11H,1H3
InChIKeyXDOKCSBZXWHRDC-UHFFFAOYSA-N
XLogP1.99
TPSA46.01 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.30
LogP ≤ 51.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

(2-Methylthiophen-3-yl)-(4-propan-2-ylthiadiazol-5-yl)methanol
CID 102842379
(4-Ethylthiadiazol-5-yl)-(2-methylthiophen-3-yl)methanol
CID 102842425
(2-Methylthiophen-3-yl)-(4-propylthiadiazol-5-yl)methanol
CID 102842516
(4-Methylthiadiazol-5-yl)-(2-methylthiophen-3-yl)methanol
CID 102842557
Thiadiazol-5-yl(thiophen-2-yl)methanol
CID 105079974
2-(1-Benzothiophen-3-yl)-1-(thiadiazol-5-yl)ethanol
CID 105083324
1-(Thiadiazol-5-yl)-2-thiophen-2-ylethanol
CID 105087175
2-(5-Ethylthiophen-2-yl)-1-(thiadiazol-5-yl)ethanol
CID 105087705
1-(Thiadiazol-5-yl)-2-thiophen-3-ylethanol
CID 105089517
1-(Thiadiazol-5-yl)-3-thiophen-3-ylpropan-1-ol
CID 105097893
1-(Thiadiazol-5-yl)-3-thiophen-2-ylpropan-1-ol
CID 105099364
(4-Methylthiadiazol-5-yl)-thiophen-3-ylmethanol
CID 105102691

Frequently Asked Questions

What is the IUPAC name of (2-methylthiophen-3-yl)-(thiadiazol-5-yl)methanol?
The IUPAC name of (2-methylthiophen-3-yl)-(thiadiazol-5-yl)methanol (CID 102842463) is (2-methylthiophen-3-yl)-(thiadiazol-5-yl)methanol.
What is the SMILES notation for (2-methylthiophen-3-yl)-(thiadiazol-5-yl)methanol?
The canonical SMILES for (2-methylthiophen-3-yl)-(thiadiazol-5-yl)methanol is Cc1sccc1C(O)c1cnns1.
What is the InChIKey of (2-methylthiophen-3-yl)-(thiadiazol-5-yl)methanol?
The InChIKey is XDOKCSBZXWHRDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8N2OS2/c1-5-6(2-3-12-5)8(11)7-4-9-10-13-7/h2-4,8,11H,1H3.
What are the key properties of (2-methylthiophen-3-yl)-(thiadiazol-5-yl)methanol?
(2-methylthiophen-3-yl)-(thiadiazol-5-yl)methanol has a molecular weight of 212.30 g/mol, XLogP of 1.99, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2-methylthiophen-3-yl)-(thiadiazol-5-yl)methanol is sourced from PubChem (CID 102842463), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).