(1-methylimidazol-4-yl)-(1,3-thiazol-2-yl)methanol

C8H9N3OS — CID 130508756

IUPAC(1-methylimidazol-4-yl)-(1,3-thiazol-2-yl)methanol
SMILESCn1cnc(C(O)c2nccs2)c1
InChIInChI=1S/C8H9N3OS/c1-11-4-6(10-5-11)7(12)8-9-2-3-13-8/h2-5,7,12H,1H3
InChIKeyUYFMOADOQGIFOW-UHFFFAOYSA-N
MW195.25 g/mol
LogP0.96
Rot. Bonds2

About (1-methylimidazol-4-yl)-(1,3-thiazol-2-yl)methanol

(1-methylimidazol-4-yl)-(1,3-thiazol-2-yl)methanol (PubChem CID 130508756) has the molecular formula C8H9N3OS and a molecular weight of 195.25 g/mol. Its IUPAC name is (1-methylimidazol-4-yl)-(1,3-thiazol-2-yl)methanol.

Molecular Properties

Compound Name(1-methylimidazol-4-yl)-(1,3-thiazol-2-yl)methanol
PubChem CID130508756
Molecular FormulaC8H9N3OS
Molecular Weight195.25 g/mol
Exact Mass195.05
IUPAC Name(1-methylimidazol-4-yl)-(1,3-thiazol-2-yl)methanol
SMILESCn1cnc(C(O)c2nccs2)c1
InChIInChI=1S/C8H9N3OS/c1-11-4-6(10-5-11)7(12)8-9-2-3-13-8/h2-5,7,12H,1H3
InChIKeyUYFMOADOQGIFOW-UHFFFAOYSA-N
XLogP0.96
TPSA50.94 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.25
LogP ≤ 50.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-(1-methylimidazol-4-yl)propane-1,2-diol
CID 130508965
(4-methoxy-1-methylpyrazol-5-yl)-(1-methylimidazol-4-yl)methanol
CID 107978707
(5-bromo-3-methyltriazol-4-yl)-(1,3-thiazol-2-yl)methanol
CID 106461391
2-(3-methylimidazol-4-yl)-1,2-bis(1,3-thiazol-2-yl)ethanol
CID 57057171
(3,5-dimethoxyphenyl)-(1-methylimidazol-4-yl)methanol
CID 114023372
2-amino-1-(1-methylimidazol-4-yl)propan-1-ol
CID 130598579
(R)-phenyl(1,3-thiazol-2-yl)methanol
CID 10511917
(1R)-2,2,2-trifluoro-1-(1-methylimidazol-4-yl)ethanol
CID 130508957
ethane;phenyl(1,3-thiazol-2-yl)methanol;hydrate
CID 142101108
(2,3-dimethylphenyl)-(1-methylimidazol-4-yl)methanol
CID 107978292
(1-methylimidazol-4-yl)-(propan-2-ylamino)methanol
CID 129044247
(2,5-dimethoxyphenyl)-(1-methylimidazol-4-yl)methanol
CID 107978350

Frequently Asked Questions

What is the IUPAC name of (1-methylimidazol-4-yl)-(1,3-thiazol-2-yl)methanol?
The IUPAC name of (1-methylimidazol-4-yl)-(1,3-thiazol-2-yl)methanol (CID 130508756) is (1-methylimidazol-4-yl)-(1,3-thiazol-2-yl)methanol.
What is the SMILES notation for (1-methylimidazol-4-yl)-(1,3-thiazol-2-yl)methanol?
The canonical SMILES for (1-methylimidazol-4-yl)-(1,3-thiazol-2-yl)methanol is Cn1cnc(C(O)c2nccs2)c1.
What is the InChIKey of (1-methylimidazol-4-yl)-(1,3-thiazol-2-yl)methanol?
The InChIKey is UYFMOADOQGIFOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9N3OS/c1-11-4-6(10-5-11)7(12)8-9-2-3-13-8/h2-5,7,12H,1H3.
What are the key properties of (1-methylimidazol-4-yl)-(1,3-thiazol-2-yl)methanol?
(1-methylimidazol-4-yl)-(1,3-thiazol-2-yl)methanol has a molecular weight of 195.25 g/mol, XLogP of 0.96, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (1-methylimidazol-4-yl)-(1,3-thiazol-2-yl)methanol is sourced from PubChem (CID 130508756), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).