(2-methyl-1,3-thiazol-5-yl)-(1,2-thiazol-3-yl)methanol

C8H8N2OS2 — CID 131064888

IUPAC(2-methyl-1,3-thiazol-5-yl)-(1,2-thiazol-3-yl)methanol
SMILESCc1ncc(C(O)c2ccsn2)s1
InChIInChI=1S/C8H8N2OS2/c1-5-9-4-7(13-5)8(11)6-2-3-12-10-6/h2-4,8,11H,1H3
InChIKeyORHJEIJNEWJTRA-UHFFFAOYSA-N
MW212.30 g/mol
LogP1.99
Rot. Bonds2

About (2-methyl-1,3-thiazol-5-yl)-(1,2-thiazol-3-yl)methanol

(2-methyl-1,3-thiazol-5-yl)-(1,2-thiazol-3-yl)methanol (PubChem CID 131064888) has the molecular formula C8H8N2OS2 and a molecular weight of 212.30 g/mol. Its IUPAC name is (2-methyl-1,3-thiazol-5-yl)-(1,2-thiazol-3-yl)methanol.

Molecular Properties

Compound Name(2-methyl-1,3-thiazol-5-yl)-(1,2-thiazol-3-yl)methanol
PubChem CID131064888
Molecular FormulaC8H8N2OS2
Molecular Weight212.30 g/mol
Exact Mass212.01
IUPAC Name(2-methyl-1,3-thiazol-5-yl)-(1,2-thiazol-3-yl)methanol
SMILESCc1ncc(C(O)c2ccsn2)s1
InChIInChI=1S/C8H8N2OS2/c1-5-9-4-7(13-5)8(11)6-2-3-12-10-6/h2-4,8,11H,1H3
InChIKeyORHJEIJNEWJTRA-UHFFFAOYSA-N
XLogP1.99
TPSA46.01 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.30
LogP ≤ 51.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-(1,2-thiazol-3-yl)propane-1,2-diol
CID 130604797
(4-methylsulfinylphenyl)-(2-methyl-1,3-thiazol-5-yl)methanol
CID 142562513
(5-bromofuran-2-yl)-(1,2-thiazol-3-yl)methanol
CID 131101510
2-methyl-5-[(2S)-3-methylbutan-2-yl]-1,3-thiazole
CID 166765987
2,2-dimethyl-1-(1,2-thiazol-3-yl)butan-1-ol
CID 130727781
methyl 2-hydroxy-2-(2-methyl-1,3-thiazol-5-yl)acetate
CID 130580412
2-methyl-1-(1,2-thiazol-3-yl)butan-1-ol
CID 131020007
2-(dimethoxyamino)-1-(2-methyl-1,3-thiazol-5-yl)ethanol
CID 178165981
(3-methyl-4-pyridinyl)-(1,2-thiazol-3-yl)methanamine
CID 130713034
2-(1-aminocyclopropyl)-1-(2-methyl-1,3-thiazol-5-yl)ethanol
CID 82398163
2-methylsulfonyl-1-(1,2-thiazol-3-yl)ethanol
CID 130752198
2-(dimethylamino)-2-(2-methyl-1,3-thiazol-5-yl)acetic acid
CID 126972584

Frequently Asked Questions

What is the IUPAC name of (2-methyl-1,3-thiazol-5-yl)-(1,2-thiazol-3-yl)methanol?
The IUPAC name of (2-methyl-1,3-thiazol-5-yl)-(1,2-thiazol-3-yl)methanol (CID 131064888) is (2-methyl-1,3-thiazol-5-yl)-(1,2-thiazol-3-yl)methanol.
What is the SMILES notation for (2-methyl-1,3-thiazol-5-yl)-(1,2-thiazol-3-yl)methanol?
The canonical SMILES for (2-methyl-1,3-thiazol-5-yl)-(1,2-thiazol-3-yl)methanol is Cc1ncc(C(O)c2ccsn2)s1.
What is the InChIKey of (2-methyl-1,3-thiazol-5-yl)-(1,2-thiazol-3-yl)methanol?
The InChIKey is ORHJEIJNEWJTRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8N2OS2/c1-5-9-4-7(13-5)8(11)6-2-3-12-10-6/h2-4,8,11H,1H3.
What are the key properties of (2-methyl-1,3-thiazol-5-yl)-(1,2-thiazol-3-yl)methanol?
(2-methyl-1,3-thiazol-5-yl)-(1,2-thiazol-3-yl)methanol has a molecular weight of 212.30 g/mol, XLogP of 1.99, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2-methyl-1,3-thiazol-5-yl)-(1,2-thiazol-3-yl)methanol is sourced from PubChem (CID 131064888), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).