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

C10H12N2OS2 — CID 102842425

IUPAC(4-ethylthiadiazol-5-yl)-(2-methylthiophen-3-yl)methanol
SMILESCCc1nnsc1C(O)c1ccsc1C
InChIInChI=1S/C10H12N2OS2/c1-3-8-10(15-12-11-8)9(13)7-4-5-14-6(7)2/h4-5,9,13H,3H2,1-2H3
InChIKeyYKAKSYSTSBFZCO-UHFFFAOYSA-N
MW240.35 g/mol
LogP2.55
Rot. Bonds3

About (4-ethylthiadiazol-5-yl)-(2-methylthiophen-3-yl)methanol

(4-ethylthiadiazol-5-yl)-(2-methylthiophen-3-yl)methanol (PubChem CID 102842425) has the molecular formula C10H12N2OS2 and a molecular weight of 240.35 g/mol. Its IUPAC name is (4-ethylthiadiazol-5-yl)-(2-methylthiophen-3-yl)methanol.

Molecular Properties

Compound Name(4-ethylthiadiazol-5-yl)-(2-methylthiophen-3-yl)methanol
PubChem CID102842425
Molecular FormulaC10H12N2OS2
Molecular Weight240.35 g/mol
Exact Mass240.04
IUPAC Name(4-ethylthiadiazol-5-yl)-(2-methylthiophen-3-yl)methanol
SMILESCCc1nnsc1C(O)c1ccsc1C
InChIInChI=1S/C10H12N2OS2/c1-3-8-10(15-12-11-8)9(13)7-4-5-14-6(7)2/h4-5,9,13H,3H2,1-2H3
InChIKeyYKAKSYSTSBFZCO-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

(3-ethyl-1-methylpyrazol-4-yl)-(2-methylthiophen-3-yl)methanol
CID 102829408
N-[(2-methylthiophen-3-yl)-(4-propylthiadiazol-5-yl)methyl]ethanamine
CID 102842118
(4-ethylthiadiazol-5-yl)-(furan-2-yl)methanol
CID 105097357
1-(4-ethylthiadiazol-5-yl)-2-(4-methyl-1,3-thiazol-2-yl)ethanol
CID 105117650
(4-propylthiadiazol-5-yl)-thiophen-2-ylmethanol
CID 105079979
(4-ethylthiadiazol-5-yl)-(3-propylphenyl)methanol
CID 105131044
2-ethyl-1-(4-ethylthiadiazol-5-yl)butan-1-ol
CID 105114668
1-(4-ethylthiadiazol-5-yl)-2-(3-methylphenyl)ethanol
CID 105077964
(4-ethylthiadiazol-5-yl)-(1-methylpyrazol-4-yl)methanol
CID 105080937
1-(4-ethylthiadiazol-5-yl)-2-(2-methylphenyl)ethanol
CID 105078091
N-methyl-1-(4-methylthiadiazol-5-yl)-1-(2-methylthiophen-3-yl)methanamine
CID 102841311
(4-ethylthiadiazol-5-yl)-[4-fluoro-3-(trifluoromethyl)phenyl]methanol
CID 107292136

Frequently Asked Questions

What is the IUPAC name of (4-ethylthiadiazol-5-yl)-(2-methylthiophen-3-yl)methanol?
The IUPAC name of (4-ethylthiadiazol-5-yl)-(2-methylthiophen-3-yl)methanol (CID 102842425) is (4-ethylthiadiazol-5-yl)-(2-methylthiophen-3-yl)methanol.
What is the SMILES notation for (4-ethylthiadiazol-5-yl)-(2-methylthiophen-3-yl)methanol?
The canonical SMILES for (4-ethylthiadiazol-5-yl)-(2-methylthiophen-3-yl)methanol is CCc1nnsc1C(O)c1ccsc1C.
What is the InChIKey of (4-ethylthiadiazol-5-yl)-(2-methylthiophen-3-yl)methanol?
The InChIKey is YKAKSYSTSBFZCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N2OS2/c1-3-8-10(15-12-11-8)9(13)7-4-5-14-6(7)2/h4-5,9,13H,3H2,1-2H3.
What are the key properties of (4-ethylthiadiazol-5-yl)-(2-methylthiophen-3-yl)methanol?
(4-ethylthiadiazol-5-yl)-(2-methylthiophen-3-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)-(2-methylthiophen-3-yl)methanol is sourced from PubChem (CID 102842425), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).