2-methoxy-1-(4-propan-2-ylthiadiazol-5-yl)ethanol

C8H14N2O2S — CID 105112129

IUPAC2-methoxy-1-(4-propan-2-ylthiadiazol-5-yl)ethanol
SMILESCOCC(O)c1snnc1C(C)C
InChIInChI=1S/C8H14N2O2S/c1-5(2)7-8(13-10-9-7)6(11)4-12-3/h5-6,11H,4H2,1-3H3
InChIKeyVZCVRCMIYLMYSW-UHFFFAOYSA-N
MW202.28 g/mol
LogP1.34
Rot. Bonds4

About 2-methoxy-1-(4-propan-2-ylthiadiazol-5-yl)ethanol

2-methoxy-1-(4-propan-2-ylthiadiazol-5-yl)ethanol (PubChem CID 105112129) has the molecular formula C8H14N2O2S and a molecular weight of 202.28 g/mol. Its IUPAC name is 2-methoxy-1-(4-propan-2-ylthiadiazol-5-yl)ethanol.

Molecular Properties

Compound Name2-methoxy-1-(4-propan-2-ylthiadiazol-5-yl)ethanol
PubChem CID105112129
Molecular FormulaC8H14N2O2S
Molecular Weight202.28 g/mol
Exact Mass202.08
IUPAC Name2-methoxy-1-(4-propan-2-ylthiadiazol-5-yl)ethanol
SMILESCOCC(O)c1snnc1C(C)C
InChIInChI=1S/C8H14N2O2S/c1-5(2)7-8(13-10-9-7)6(11)4-12-3/h5-6,11H,4H2,1-3H3
InChIKeyVZCVRCMIYLMYSW-UHFFFAOYSA-N
XLogP1.34
TPSA55.24 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.28
LogP ≤ 51.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-(4-tert-butylthiadiazol-5-yl)-2-methoxyethanol
CID 105112166
1-(4-propan-2-ylthiadiazol-5-yl)hexan-1-ol
CID 105086118
[4-methoxy-2-methyl-1-(4-propan-2-ylthiadiazol-5-yl)butyl]hydrazine
CID 105338088
3-ethyl-1-(4-propan-2-ylthiadiazol-5-yl)heptan-1-ol
CID 105080603
cyclopentyl-(4-propan-2-ylthiadiazol-5-yl)methanol
CID 105133985
2-(5-chlorothiophen-2-yl)-1-(4-propan-2-ylthiadiazol-5-yl)ethanol
CID 105087426
2-(3,4-difluorophenyl)-1-(4-propan-2-ylthiadiazol-5-yl)ethanol
CID 105121858
(3,5-dimethoxyphenyl)-(4-propan-2-ylthiadiazol-5-yl)methanol
CID 105114504
cyclohexyl-(4-propan-2-ylthiadiazol-5-yl)methanol
CID 105100605
2-(2-methyl-1,2,4-triazol-3-yl)-1-(4-propan-2-ylthiadiazol-5-yl)ethanol
CID 105107127
4-methoxy-2-methyl-1-(4-propan-2-ylthiadiazol-5-yl)butan-1-one
CID 105131662
2-(2,4-dichlorophenyl)-1-(4-propan-2-ylthiadiazol-5-yl)ethanol
CID 105086779

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-1-(4-propan-2-ylthiadiazol-5-yl)ethanol?
The IUPAC name of 2-methoxy-1-(4-propan-2-ylthiadiazol-5-yl)ethanol (CID 105112129) is 2-methoxy-1-(4-propan-2-ylthiadiazol-5-yl)ethanol.
What is the SMILES notation for 2-methoxy-1-(4-propan-2-ylthiadiazol-5-yl)ethanol?
The canonical SMILES for 2-methoxy-1-(4-propan-2-ylthiadiazol-5-yl)ethanol is COCC(O)c1snnc1C(C)C.
What is the InChIKey of 2-methoxy-1-(4-propan-2-ylthiadiazol-5-yl)ethanol?
The InChIKey is VZCVRCMIYLMYSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N2O2S/c1-5(2)7-8(13-10-9-7)6(11)4-12-3/h5-6,11H,4H2,1-3H3.
What are the key properties of 2-methoxy-1-(4-propan-2-ylthiadiazol-5-yl)ethanol?
2-methoxy-1-(4-propan-2-ylthiadiazol-5-yl)ethanol has a molecular weight of 202.28 g/mol, XLogP of 1.34, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-1-(4-propan-2-ylthiadiazol-5-yl)ethanol is sourced from PubChem (CID 105112129), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).