[2-(1-methoxy-2,2-dimethylpropyl)-1,3-thiazol-5-yl]methanol

C10H17NO2S — CID 116734405

IUPAC[2-(1-methoxy-2,2-dimethylpropyl)-1,3-thiazol-5-yl]methanol
SMILESCOC(c1ncc(CO)s1)C(C)(C)C
InChIInChI=1S/C10H17NO2S/c1-10(2,3)8(13-4)9-11-5-7(6-12)14-9/h5,8,12H,6H2,1-4H3
InChIKeyFCEBMEPMBXJBLC-UHFFFAOYSA-N
MW215.32 g/mol
LogP2.37
Rot. Bonds3

About [2-(1-methoxy-2,2-dimethylpropyl)-1,3-thiazol-5-yl]methanol

[2-(1-methoxy-2,2-dimethylpropyl)-1,3-thiazol-5-yl]methanol (PubChem CID 116734405) has the molecular formula C10H17NO2S and a molecular weight of 215.32 g/mol. Its IUPAC name is [2-(1-methoxy-2,2-dimethylpropyl)-1,3-thiazol-5-yl]methanol.

Molecular Properties

Compound Name[2-(1-methoxy-2,2-dimethylpropyl)-1,3-thiazol-5-yl]methanol
PubChem CID116734405
Molecular FormulaC10H17NO2S
Molecular Weight215.32 g/mol
Exact Mass215.10
IUPAC Name[2-(1-methoxy-2,2-dimethylpropyl)-1,3-thiazol-5-yl]methanol
SMILESCOC(c1ncc(CO)s1)C(C)(C)C
InChIInChI=1S/C10H17NO2S/c1-10(2,3)8(13-4)9-11-5-7(6-12)14-9/h5,8,12H,6H2,1-4H3
InChIKeyFCEBMEPMBXJBLC-UHFFFAOYSA-N
XLogP2.37
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.32
LogP ≤ 52.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[2-(1-methoxypropan-2-yl)-1,3-thiazol-5-yl]methanol
CID 116503382
(2-pentan-3-yl-1,3-thiazol-5-yl)methanol
CID 64981660
1-[2-(1-ethoxy-2,2-dimethylpropyl)-1,3-thiazol-5-yl]ethanol
CID 116728250
4-azido-1-[5-(hydroxymethyl)-1,3-thiazol-2-yl]butane-1,2-diol
CID 171878964
[4-ethyl-2-(1-methoxy-2,2-dimethylpropyl)pyrimidin-5-yl]methanol
CID 114205053
N-[[2-(1-methoxy-2-methylpropyl)-1,3-thiazol-5-yl]methyl]propan-2-amine
CID 116727637
N-[[2-(1-methoxypropyl)-1,3-thiazol-5-yl]methyl]ethanamine
CID 116727612
methyl 3-[5-(hydroxymethyl)-1,3-thiazol-2-yl]prop-2-enoate
CID 169478664
[2-(2-methyl-1,3-dioxol-2-yl)-1,3-thiazol-5-yl]methanol
CID 141238128
methyl 3-(2-propan-2-yl-1,3-thiazol-5-yl)propanoate
CID 58898126
N-[1-(5-ethyl-1,3-thiazol-2-yl)ethyl]-4-methoxy-4-methylpentan-2-amine
CID 112700494
[2-(1-methoxy-2,2-dimethylpropyl)-4-(methoxymethyl)-1,3-thiazol-5-yl]methanamine
CID 114361610

Frequently Asked Questions

What is the IUPAC name of [2-(1-methoxy-2,2-dimethylpropyl)-1,3-thiazol-5-yl]methanol?
The IUPAC name of [2-(1-methoxy-2,2-dimethylpropyl)-1,3-thiazol-5-yl]methanol (CID 116734405) is [2-(1-methoxy-2,2-dimethylpropyl)-1,3-thiazol-5-yl]methanol.
What is the SMILES notation for [2-(1-methoxy-2,2-dimethylpropyl)-1,3-thiazol-5-yl]methanol?
The canonical SMILES for [2-(1-methoxy-2,2-dimethylpropyl)-1,3-thiazol-5-yl]methanol is COC(c1ncc(CO)s1)C(C)(C)C.
What is the InChIKey of [2-(1-methoxy-2,2-dimethylpropyl)-1,3-thiazol-5-yl]methanol?
The InChIKey is FCEBMEPMBXJBLC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17NO2S/c1-10(2,3)8(13-4)9-11-5-7(6-12)14-9/h5,8,12H,6H2,1-4H3.
What are the key properties of [2-(1-methoxy-2,2-dimethylpropyl)-1,3-thiazol-5-yl]methanol?
[2-(1-methoxy-2,2-dimethylpropyl)-1,3-thiazol-5-yl]methanol has a molecular weight of 215.32 g/mol, XLogP of 2.37, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(1-methoxy-2,2-dimethylpropyl)-1,3-thiazol-5-yl]methanol is sourced from PubChem (CID 116734405), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).