(2-methoxy-4-pyrazol-1-yl-1,3-thiazol-5-yl)methanol

C8H9N3O2S — CID 130580255

IUPAC(2-methoxy-4-pyrazol-1-yl-1,3-thiazol-5-yl)methanol
SMILESCOc1nc(-n2cccn2)c(CO)s1
InChIInChI=1S/C8H9N3O2S/c1-13-8-10-7(6(5-12)14-8)11-4-2-3-9-11/h2-4,12H,5H2,1H3
InChIKeyVEDWBHSOWUOCIV-UHFFFAOYSA-N
MW211.25 g/mol
LogP0.83
Rot. Bonds3

About (2-methoxy-4-pyrazol-1-yl-1,3-thiazol-5-yl)methanol

(2-methoxy-4-pyrazol-1-yl-1,3-thiazol-5-yl)methanol (PubChem CID 130580255) has the molecular formula C8H9N3O2S and a molecular weight of 211.25 g/mol. Its IUPAC name is (2-methoxy-4-pyrazol-1-yl-1,3-thiazol-5-yl)methanol.

Molecular Properties

Compound Name(2-methoxy-4-pyrazol-1-yl-1,3-thiazol-5-yl)methanol
PubChem CID130580255
Molecular FormulaC8H9N3O2S
Molecular Weight211.25 g/mol
Exact Mass211.04
IUPAC Name(2-methoxy-4-pyrazol-1-yl-1,3-thiazol-5-yl)methanol
SMILESCOc1nc(-n2cccn2)c(CO)s1
InChIInChI=1S/C8H9N3O2S/c1-13-8-10-7(6(5-12)14-8)11-4-2-3-9-11/h2-4,12H,5H2,1H3
InChIKeyVEDWBHSOWUOCIV-UHFFFAOYSA-N
XLogP0.83
TPSA60.17 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.25
LogP ≤ 50.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

5-(chloromethyl)-4-(4-iodopyrazol-1-yl)-2-methoxy-1,3-thiazole
CID 130580275
[4-(4-tert-butylphenyl)-2-methoxy-1,3-thiazol-5-yl]methanol
CID 131867614
[4-(5-bromo-2-methoxyphenyl)-2-methoxy-1,3-thiazol-5-yl]methanol
CID 131866787
(3-fluoro-2-pyrazol-1-yl-4-pyridinyl)methanol
CID 105383202
4-(hydroxymethyl)-1-(2-methyl-6-pyrazol-1-ylpyrimidin-4-yl)piperidin-4-ol
CID 56748397
2-methyl-3-pyrazol-1-ylpyrazine
CID 83066223
[3-(2-methoxy-4-pyrazol-1-ylphenyl)-2,5-dimethylpyrazolo[1,5-a]pyrimidin-7-yl]methanol
CID 59026282
3-methoxy-5-pyrazol-1-ylphenol
CID 165141321
3-ethyl-2-methoxy-6-pyrazol-1-ylbenzoic acid
CID 157483711
ethane;2-methyl-3-pyrazol-1-ylpyrazine
CID 145106311
(1S,5S)-9-(2,4-dimethoxypyrimidin-5-yl)-3-[(2-pyrazol-1-ylphenyl)methyl]-3-azabicyclo[3.3.1]nonan-9-ol
CID 98132312
(1R,5R)-9-(2,4-dimethoxypyrimidin-5-yl)-3-[(2-pyrazol-1-ylphenyl)methyl]-3-azabicyclo[3.3.1]nonan-9-ol
CID 98132311

Frequently Asked Questions

What is the IUPAC name of (2-methoxy-4-pyrazol-1-yl-1,3-thiazol-5-yl)methanol?
The IUPAC name of (2-methoxy-4-pyrazol-1-yl-1,3-thiazol-5-yl)methanol (CID 130580255) is (2-methoxy-4-pyrazol-1-yl-1,3-thiazol-5-yl)methanol.
What is the SMILES notation for (2-methoxy-4-pyrazol-1-yl-1,3-thiazol-5-yl)methanol?
The canonical SMILES for (2-methoxy-4-pyrazol-1-yl-1,3-thiazol-5-yl)methanol is COc1nc(-n2cccn2)c(CO)s1.
What is the InChIKey of (2-methoxy-4-pyrazol-1-yl-1,3-thiazol-5-yl)methanol?
The InChIKey is VEDWBHSOWUOCIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9N3O2S/c1-13-8-10-7(6(5-12)14-8)11-4-2-3-9-11/h2-4,12H,5H2,1H3.
What are the key properties of (2-methoxy-4-pyrazol-1-yl-1,3-thiazol-5-yl)methanol?
(2-methoxy-4-pyrazol-1-yl-1,3-thiazol-5-yl)methanol has a molecular weight of 211.25 g/mol, XLogP of 0.83, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (2-methoxy-4-pyrazol-1-yl-1,3-thiazol-5-yl)methanol is sourced from PubChem (CID 130580255), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).