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

C10H11NOS2 — CID 130604946

IUPAC(3-methyl-1,2-thiazol-5-yl)-(2-methylthiophen-3-yl)methanol
SMILESCc1cc(C(O)c2ccsc2C)sn1
InChIInChI=1S/C10H11NOS2/c1-6-5-9(14-11-6)10(12)8-3-4-13-7(8)2/h3-5,10,12H,1-2H3
InChIKeyFNLKPEPWQSMKDZ-UHFFFAOYSA-N
MW225.34 g/mol
LogP2.90
Rot. Bonds2

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

(3-methyl-1,2-thiazol-5-yl)-(2-methylthiophen-3-yl)methanol (PubChem CID 130604946) has the molecular formula C10H11NOS2 and a molecular weight of 225.34 g/mol. Its IUPAC name is (3-methyl-1,2-thiazol-5-yl)-(2-methylthiophen-3-yl)methanol.

Molecular Properties

Compound Name(3-methyl-1,2-thiazol-5-yl)-(2-methylthiophen-3-yl)methanol
PubChem CID130604946
Molecular FormulaC10H11NOS2
Molecular Weight225.34 g/mol
Exact Mass225.03
IUPAC Name(3-methyl-1,2-thiazol-5-yl)-(2-methylthiophen-3-yl)methanol
SMILESCc1cc(C(O)c2ccsc2C)sn1
InChIInChI=1S/C10H11NOS2/c1-6-5-9(14-11-6)10(12)8-3-4-13-7(8)2/h3-5,10,12H,1-2H3
InChIKeyFNLKPEPWQSMKDZ-UHFFFAOYSA-N
XLogP2.90
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.34
LogP ≤ 52.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(4-Fluorophenyl)-(3-methyl-1,2-thiazol-5-yl)methanol
CID 119094110
(3-Methyl-1,2-thiazol-5-yl)-phenylmethanol
CID 91620842
(2-Fluorophenyl)-(3-methyl-1,2-thiazol-5-yl)methanol
CID 119094109
(3-Fluorothiophen-2-yl)-(3-methyl-1,2-thiazol-5-yl)methanol
CID 130653495
(3-Thiophen-3-yl-1,2-thiazol-5-yl)methanol
CID 19744568
3-Phenyl-5-(1-hydroxybutyl)isothiazole
CID 19976910
(2-Methylthiophen-3-yl)-(4-propan-2-ylthiadiazol-5-yl)methanol
CID 102842379
(4-Ethylthiadiazol-5-yl)-(2-methylthiophen-3-yl)methanol
CID 102842425
(3,6-Dimethylpyridazin-4-yl)-(2-methylthiophen-3-yl)methanol
CID 102842472
(2-Methylthiophen-3-yl)-(4-propylthiadiazol-5-yl)methanol
CID 102842516
(3,6-Dimethylpyridazin-4-yl)-thiophen-2-ylmethanol
CID 105079918
(3-Ethyl-6-methylpyridazin-4-yl)-thiophen-2-ylmethanol
CID 105079947

Frequently Asked Questions

What is the IUPAC name of (3-methyl-1,2-thiazol-5-yl)-(2-methylthiophen-3-yl)methanol?
The IUPAC name of (3-methyl-1,2-thiazol-5-yl)-(2-methylthiophen-3-yl)methanol (CID 130604946) is (3-methyl-1,2-thiazol-5-yl)-(2-methylthiophen-3-yl)methanol.
What is the SMILES notation for (3-methyl-1,2-thiazol-5-yl)-(2-methylthiophen-3-yl)methanol?
The canonical SMILES for (3-methyl-1,2-thiazol-5-yl)-(2-methylthiophen-3-yl)methanol is Cc1cc(C(O)c2ccsc2C)sn1.
What is the InChIKey of (3-methyl-1,2-thiazol-5-yl)-(2-methylthiophen-3-yl)methanol?
The InChIKey is FNLKPEPWQSMKDZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11NOS2/c1-6-5-9(14-11-6)10(12)8-3-4-13-7(8)2/h3-5,10,12H,1-2H3.
What are the key properties of (3-methyl-1,2-thiazol-5-yl)-(2-methylthiophen-3-yl)methanol?
(3-methyl-1,2-thiazol-5-yl)-(2-methylthiophen-3-yl)methanol has a molecular weight of 225.34 g/mol, XLogP of 2.90, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3-methyl-1,2-thiazol-5-yl)-(2-methylthiophen-3-yl)methanol is sourced from PubChem (CID 130604946), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).