2-(2-methoxypropan-2-yl)-1,3-thiazole

C7H11NOS — CID 58221731

IUPAC2-(2-methoxypropan-2-yl)-1,3-thiazole
SMILESCOC(C)(C)c1nccs1
InChIInChI=1S/C7H11NOS/c1-7(2,9-3)6-8-4-5-10-6/h4-5H,1-3H3
InChIKeyRKCFNGPDBVWAJY-UHFFFAOYSA-N
MW157.24 g/mol
LogP2.02
Rot. Bonds2

About 2-(2-methoxypropan-2-yl)-1,3-thiazole

2-(2-methoxypropan-2-yl)-1,3-thiazole (PubChem CID 58221731) has the molecular formula C7H11NOS and a molecular weight of 157.24 g/mol. Its IUPAC name is 2-(2-methoxypropan-2-yl)-1,3-thiazole.

Molecular Properties

Compound Name2-(2-methoxypropan-2-yl)-1,3-thiazole
PubChem CID58221731
Molecular FormulaC7H11NOS
Molecular Weight157.24 g/mol
Exact Mass157.06
IUPAC Name2-(2-methoxypropan-2-yl)-1,3-thiazole
SMILESCOC(C)(C)c1nccs1
InChIInChI=1S/C7H11NOS/c1-7(2,9-3)6-8-4-5-10-6/h4-5H,1-3H3
InChIKeyRKCFNGPDBVWAJY-UHFFFAOYSA-N
XLogP2.02
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.24
LogP ≤ 52.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(2-methoxypropan-2-yl)-1,3-thiazole?
The IUPAC name of 2-(2-methoxypropan-2-yl)-1,3-thiazole (CID 58221731) is 2-(2-methoxypropan-2-yl)-1,3-thiazole.
What is the SMILES notation for 2-(2-methoxypropan-2-yl)-1,3-thiazole?
The canonical SMILES for 2-(2-methoxypropan-2-yl)-1,3-thiazole is COC(C)(C)c1nccs1.
What is the InChIKey of 2-(2-methoxypropan-2-yl)-1,3-thiazole?
The InChIKey is RKCFNGPDBVWAJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11NOS/c1-7(2,9-3)6-8-4-5-10-6/h4-5H,1-3H3.
What are the key properties of 2-(2-methoxypropan-2-yl)-1,3-thiazole?
2-(2-methoxypropan-2-yl)-1,3-thiazole has a molecular weight of 157.24 g/mol, XLogP of 2.02, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxypropan-2-yl)-1,3-thiazole is sourced from PubChem (CID 58221731), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).