2-[4-(methoxymethyl)-1,3-thiazol-2-yl]propan-2-ol

C8H13NO2S — CID 146570950

IUPAC2-[4-(methoxymethyl)-1,3-thiazol-2-yl]propan-2-ol
SMILESCOCc1csc(C(C)(C)O)n1
InChIInChI=1S/C8H13NO2S/c1-8(2,10)7-9-6(4-11-3)5-12-7/h5,10H,4H2,1-3H3
InChIKeyPJGUNIHVFNYGDO-UHFFFAOYSA-N
MW187.26 g/mol
LogP1.52
Rot. Bonds3

About 2-[4-(methoxymethyl)-1,3-thiazol-2-yl]propan-2-ol

2-[4-(methoxymethyl)-1,3-thiazol-2-yl]propan-2-ol (PubChem CID 146570950) has the molecular formula C8H13NO2S and a molecular weight of 187.26 g/mol. Its IUPAC name is 2-[4-(methoxymethyl)-1,3-thiazol-2-yl]propan-2-ol.

Molecular Properties

Compound Name2-[4-(methoxymethyl)-1,3-thiazol-2-yl]propan-2-ol
PubChem CID146570950
Molecular FormulaC8H13NO2S
Molecular Weight187.26 g/mol
Exact Mass187.07
IUPAC Name2-[4-(methoxymethyl)-1,3-thiazol-2-yl]propan-2-ol
SMILESCOCc1csc(C(C)(C)O)n1
InChIInChI=1S/C8H13NO2S/c1-8(2,10)7-9-6(4-11-3)5-12-7/h5,10H,4H2,1-3H3
InChIKeyPJGUNIHVFNYGDO-UHFFFAOYSA-N
XLogP1.52
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.26
LogP ≤ 51.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-[4-(methoxymethyl)-1,3-thiazol-2-yl]-2,2-dimethylpropan-1-amine
CID 107507037
[4-(methoxymethyl)-1,3-thiazol-2-yl]carbamic acid
CID 87285914
methyl 2-[(2-tert-butyl-1,3-thiazol-4-yl)methylamino]-2-methylpropanoate
CID 115609824
2-[4-(methoxymethyl)-1,3-thiazol-2-yl]-1,1-dimethylhydrazine
CID 131059203
2-[4-[(2-tert-butyl-1,3-thiazol-4-yl)methoxy]phenoxy]ethanol
CID 111630061
[4-[(2-tert-butyl-1,3-thiazol-4-yl)methoxy]phenyl]methanol
CID 110891814
ethyl (2S)-2-(4-ethyl-1,3-thiazol-2-yl)-2-hydroxypropanoate
CID 129388918
2-(2,2-dimethylcyclopropyl)-4-(methoxymethyl)-1,3-thiazole
CID 107924795
2-[4-(methoxymethyl)-1,3-thiazol-2-yl]aniline
CID 107507057
4-(methoxymethyl)-2-(2-methoxypropyl)-1,3-thiazole
CID 107511985
4-(methoxymethyl)-2-(1-methoxy-2-methylpropyl)-1,3-thiazole
CID 107511953
2-(4-bromothiophen-3-yl)-4-(methoxymethyl)-1,3-thiazole
CID 167839205

Frequently Asked Questions

What is the IUPAC name of 2-[4-(methoxymethyl)-1,3-thiazol-2-yl]propan-2-ol?
The IUPAC name of 2-[4-(methoxymethyl)-1,3-thiazol-2-yl]propan-2-ol (CID 146570950) is 2-[4-(methoxymethyl)-1,3-thiazol-2-yl]propan-2-ol.
What is the SMILES notation for 2-[4-(methoxymethyl)-1,3-thiazol-2-yl]propan-2-ol?
The canonical SMILES for 2-[4-(methoxymethyl)-1,3-thiazol-2-yl]propan-2-ol is COCc1csc(C(C)(C)O)n1.
What is the InChIKey of 2-[4-(methoxymethyl)-1,3-thiazol-2-yl]propan-2-ol?
The InChIKey is PJGUNIHVFNYGDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13NO2S/c1-8(2,10)7-9-6(4-11-3)5-12-7/h5,10H,4H2,1-3H3.
What are the key properties of 2-[4-(methoxymethyl)-1,3-thiazol-2-yl]propan-2-ol?
2-[4-(methoxymethyl)-1,3-thiazol-2-yl]propan-2-ol has a molecular weight of 187.26 g/mol, XLogP of 1.52, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(methoxymethyl)-1,3-thiazol-2-yl]propan-2-ol is sourced from PubChem (CID 146570950), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).