(2-methylthiophen-3-yl)-(thiadiazol-4-yl)methanol

C8H8N2OS2 — CID 102842253

IUPAC(2-methylthiophen-3-yl)-(thiadiazol-4-yl)methanol
SMILESCc1sccc1C(O)c1csnn1
InChIInChI=1S/C8H8N2OS2/c1-5-6(2-3-12-5)8(11)7-4-13-10-9-7/h2-4,8,11H,1H3
InChIKeyADIIQNHMJDVCQT-UHFFFAOYSA-N
MW212.30 g/mol
LogP1.99
Rot. Bonds2

About (2-methylthiophen-3-yl)-(thiadiazol-4-yl)methanol

(2-methylthiophen-3-yl)-(thiadiazol-4-yl)methanol (PubChem CID 102842253) has the molecular formula C8H8N2OS2 and a molecular weight of 212.30 g/mol. Its IUPAC name is (2-methylthiophen-3-yl)-(thiadiazol-4-yl)methanol.

Molecular Properties

Compound Name(2-methylthiophen-3-yl)-(thiadiazol-4-yl)methanol
PubChem CID102842253
Molecular FormulaC8H8N2OS2
Molecular Weight212.30 g/mol
Exact Mass212.01
IUPAC Name(2-methylthiophen-3-yl)-(thiadiazol-4-yl)methanol
SMILESCc1sccc1C(O)c1csnn1
InChIInChI=1S/C8H8N2OS2/c1-5-6(2-3-12-5)8(11)7-4-13-10-9-7/h2-4,8,11H,1H3
InChIKeyADIIQNHMJDVCQT-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

(5-Ethylsulfanylthiadiazol-4-yl)-phenylmethanol
CID 12348742
(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
(4-Methylthiadiazol-5-yl)-thiophen-2-ylmethanol
CID 105079900
(4-Propan-2-ylthiadiazol-5-yl)-thiophen-2-ylmethanol
CID 105079956
(4-Ethylthiadiazol-5-yl)-thiophen-2-ylmethanol
CID 105079958
(4-Tert-butylthiadiazol-5-yl)-thiophen-2-ylmethanol
CID 105079978
(4-Propylthiadiazol-5-yl)-thiophen-2-ylmethanol
CID 105079979
1-(4-Methylthiadiazol-5-yl)-2-thiophen-2-ylethanol
CID 105087134
1-(Thiadiazol-4-yl)-2-thiophen-2-ylethanol
CID 105087160

Frequently Asked Questions

What is the IUPAC name of (2-methylthiophen-3-yl)-(thiadiazol-4-yl)methanol?
The IUPAC name of (2-methylthiophen-3-yl)-(thiadiazol-4-yl)methanol (CID 102842253) is (2-methylthiophen-3-yl)-(thiadiazol-4-yl)methanol.
What is the SMILES notation for (2-methylthiophen-3-yl)-(thiadiazol-4-yl)methanol?
The canonical SMILES for (2-methylthiophen-3-yl)-(thiadiazol-4-yl)methanol is Cc1sccc1C(O)c1csnn1.
What is the InChIKey of (2-methylthiophen-3-yl)-(thiadiazol-4-yl)methanol?
The InChIKey is ADIIQNHMJDVCQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8N2OS2/c1-5-6(2-3-12-5)8(11)7-4-13-10-9-7/h2-4,8,11H,1H3.
What are the key properties of (2-methylthiophen-3-yl)-(thiadiazol-4-yl)methanol?
(2-methylthiophen-3-yl)-(thiadiazol-4-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-4-yl)methanol is sourced from PubChem (CID 102842253), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).