2-(2-methoxypropan-2-yl)-5-methyl-1,3-thiazol-4-amine

C8H14N2OS — CID 83108757

IUPAC2-(2-methoxypropan-2-yl)-5-methyl-1,3-thiazol-4-amine
SMILESCOC(C)(C)c1nc(N)c(C)s1
InChIInChI=1S/C8H14N2OS/c1-5-6(9)10-7(12-5)8(2,3)11-4/h9H2,1-4H3
InChIKeyVRCIJLBKEOCNNC-UHFFFAOYSA-N
MW186.28 g/mol
LogP1.92
Rot. Bonds2

About 2-(2-methoxypropan-2-yl)-5-methyl-1,3-thiazol-4-amine

2-(2-methoxypropan-2-yl)-5-methyl-1,3-thiazol-4-amine (PubChem CID 83108757) has the molecular formula C8H14N2OS and a molecular weight of 186.28 g/mol. Its IUPAC name is 2-(2-methoxypropan-2-yl)-5-methyl-1,3-thiazol-4-amine.

Molecular Properties

Compound Name2-(2-methoxypropan-2-yl)-5-methyl-1,3-thiazol-4-amine
PubChem CID83108757
Molecular FormulaC8H14N2OS
Molecular Weight186.28 g/mol
Exact Mass186.08
IUPAC Name2-(2-methoxypropan-2-yl)-5-methyl-1,3-thiazol-4-amine
SMILESCOC(C)(C)c1nc(N)c(C)s1
InChIInChI=1S/C8H14N2OS/c1-5-6(9)10-7(12-5)8(2,3)11-4/h9H2,1-4H3
InChIKeyVRCIJLBKEOCNNC-UHFFFAOYSA-N
XLogP1.92
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.28
LogP ≤ 51.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(2-methoxypropan-2-yl)-5-methyl-1,3-thiazol-4-amine?
The IUPAC name of 2-(2-methoxypropan-2-yl)-5-methyl-1,3-thiazol-4-amine (CID 83108757) is 2-(2-methoxypropan-2-yl)-5-methyl-1,3-thiazol-4-amine.
What is the SMILES notation for 2-(2-methoxypropan-2-yl)-5-methyl-1,3-thiazol-4-amine?
The canonical SMILES for 2-(2-methoxypropan-2-yl)-5-methyl-1,3-thiazol-4-amine is COC(C)(C)c1nc(N)c(C)s1.
What is the InChIKey of 2-(2-methoxypropan-2-yl)-5-methyl-1,3-thiazol-4-amine?
The InChIKey is VRCIJLBKEOCNNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N2OS/c1-5-6(9)10-7(12-5)8(2,3)11-4/h9H2,1-4H3.
What are the key properties of 2-(2-methoxypropan-2-yl)-5-methyl-1,3-thiazol-4-amine?
2-(2-methoxypropan-2-yl)-5-methyl-1,3-thiazol-4-amine has a molecular weight of 186.28 g/mol, XLogP of 1.92, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxypropan-2-yl)-5-methyl-1,3-thiazol-4-amine is sourced from PubChem (CID 83108757), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).