(4-ethylthiadiazol-5-yl)-(5-methylthiophen-2-yl)methanol

C10H12N2OS2 — CID 105109313

IUPAC(4-ethylthiadiazol-5-yl)-(5-methylthiophen-2-yl)methanol
SMILESCCc1nnsc1C(O)c1ccc(C)s1
InChIInChI=1S/C10H12N2OS2/c1-3-7-10(15-12-11-7)9(13)8-5-4-6(2)14-8/h4-5,9,13H,3H2,1-2H3
InChIKeyWXUJCGUDBFNDTG-UHFFFAOYSA-N
MW240.35 g/mol
LogP2.55
Rot. Bonds3

About (4-ethylthiadiazol-5-yl)-(5-methylthiophen-2-yl)methanol

(4-ethylthiadiazol-5-yl)-(5-methylthiophen-2-yl)methanol (PubChem CID 105109313) has the molecular formula C10H12N2OS2 and a molecular weight of 240.35 g/mol. Its IUPAC name is (4-ethylthiadiazol-5-yl)-(5-methylthiophen-2-yl)methanol.

Molecular Properties

Compound Name(4-ethylthiadiazol-5-yl)-(5-methylthiophen-2-yl)methanol
PubChem CID105109313
Molecular FormulaC10H12N2OS2
Molecular Weight240.35 g/mol
Exact Mass240.04
IUPAC Name(4-ethylthiadiazol-5-yl)-(5-methylthiophen-2-yl)methanol
SMILESCCc1nnsc1C(O)c1ccc(C)s1
InChIInChI=1S/C10H12N2OS2/c1-3-7-10(15-12-11-7)9(13)8-5-4-6(2)14-8/h4-5,9,13H,3H2,1-2H3
InChIKeyWXUJCGUDBFNDTG-UHFFFAOYSA-N
XLogP2.55
TPSA46.01 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.35
LogP ≤ 52.55
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
(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
2-(1-Benzothiophen-3-yl)-1-(4-ethylthiadiazol-5-yl)ethanol
CID 105083304
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 (4-ethylthiadiazol-5-yl)-(5-methylthiophen-2-yl)methanol?
The IUPAC name of (4-ethylthiadiazol-5-yl)-(5-methylthiophen-2-yl)methanol (CID 105109313) is (4-ethylthiadiazol-5-yl)-(5-methylthiophen-2-yl)methanol.
What is the SMILES notation for (4-ethylthiadiazol-5-yl)-(5-methylthiophen-2-yl)methanol?
The canonical SMILES for (4-ethylthiadiazol-5-yl)-(5-methylthiophen-2-yl)methanol is CCc1nnsc1C(O)c1ccc(C)s1.
What is the InChIKey of (4-ethylthiadiazol-5-yl)-(5-methylthiophen-2-yl)methanol?
The InChIKey is WXUJCGUDBFNDTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N2OS2/c1-3-7-10(15-12-11-7)9(13)8-5-4-6(2)14-8/h4-5,9,13H,3H2,1-2H3.
What are the key properties of (4-ethylthiadiazol-5-yl)-(5-methylthiophen-2-yl)methanol?
(4-ethylthiadiazol-5-yl)-(5-methylthiophen-2-yl)methanol has a molecular weight of 240.35 g/mol, XLogP of 2.55, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (4-ethylthiadiazol-5-yl)-(5-methylthiophen-2-yl)methanol is sourced from PubChem (CID 105109313), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).