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

C9H10N2O2S — CID 105097357

IUPAC(4-ethylthiadiazol-5-yl)-(furan-2-yl)methanol
SMILESCCc1nnsc1C(O)c1ccco1
InChIInChI=1S/C9H10N2O2S/c1-2-6-9(14-11-10-6)8(12)7-4-3-5-13-7/h3-5,8,12H,2H2,1H3
InChIKeyJQFPZGGZYGTXCP-UHFFFAOYSA-N
MW210.26 g/mol
LogP1.78
Rot. Bonds3

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

(4-ethylthiadiazol-5-yl)-(furan-2-yl)methanol (PubChem CID 105097357) has the molecular formula C9H10N2O2S and a molecular weight of 210.26 g/mol. Its IUPAC name is (4-ethylthiadiazol-5-yl)-(furan-2-yl)methanol.

Molecular Properties

Compound Name(4-ethylthiadiazol-5-yl)-(furan-2-yl)methanol
PubChem CID105097357
Molecular FormulaC9H10N2O2S
Molecular Weight210.26 g/mol
Exact Mass210.05
IUPAC Name(4-ethylthiadiazol-5-yl)-(furan-2-yl)methanol
SMILESCCc1nnsc1C(O)c1ccco1
InChIInChI=1S/C9H10N2O2S/c1-2-6-9(14-11-10-6)8(12)7-4-3-5-13-7/h3-5,8,12H,2H2,1H3
InChIKeyJQFPZGGZYGTXCP-UHFFFAOYSA-N
XLogP1.78
TPSA59.15 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.26
LogP ≤ 51.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

furan-2-yl-(4-propylthiadiazol-5-yl)methanol
CID 105097375
1-(4-ethylthiadiazol-5-yl)-2-(furan-2-yl)ethanol
CID 105122955
(4-ethylthiadiazol-5-yl)-(2-methylthiophen-3-yl)methanol
CID 102842425
(4-ethylthiadiazol-5-yl)-[3-(2-methylpropyl)phenyl]methanol
CID 105131171
(3-bromofuran-2-yl)-(4-propylthiadiazol-5-yl)methanol
CID 105099534
furan-2-yl-(4-methyl-1,3-thiazol-5-yl)methanol
CID 22101827
1-(4-ethylthiadiazol-5-yl)-2-(3-methylphenyl)ethanol
CID 105077964
(4-ethylthiadiazol-5-yl)-(1-methylpyrazol-4-yl)methanol
CID 105080937
(4-ethylthiadiazol-5-yl)-[4-fluoro-3-(trifluoromethyl)phenyl]methanol
CID 107292136
(4-propylthiadiazol-5-yl)-thiophen-2-ylmethanol
CID 105079979
2-(4-chlorophenyl)-1-(4-ethylthiadiazol-5-yl)ethanol
CID 105076672
1-(4-ethylthiadiazol-5-yl)-2-(4-iodophenyl)ethanol
CID 105101035

Frequently Asked Questions

What is the IUPAC name of (4-ethylthiadiazol-5-yl)-(furan-2-yl)methanol?
The IUPAC name of (4-ethylthiadiazol-5-yl)-(furan-2-yl)methanol (CID 105097357) is (4-ethylthiadiazol-5-yl)-(furan-2-yl)methanol.
What is the SMILES notation for (4-ethylthiadiazol-5-yl)-(furan-2-yl)methanol?
The canonical SMILES for (4-ethylthiadiazol-5-yl)-(furan-2-yl)methanol is CCc1nnsc1C(O)c1ccco1.
What is the InChIKey of (4-ethylthiadiazol-5-yl)-(furan-2-yl)methanol?
The InChIKey is JQFPZGGZYGTXCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10N2O2S/c1-2-6-9(14-11-10-6)8(12)7-4-3-5-13-7/h3-5,8,12H,2H2,1H3.
What are the key properties of (4-ethylthiadiazol-5-yl)-(furan-2-yl)methanol?
(4-ethylthiadiazol-5-yl)-(furan-2-yl)methanol has a molecular weight of 210.26 g/mol, XLogP of 1.78, 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)-(furan-2-yl)methanol is sourced from PubChem (CID 105097357), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).