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

C7H11NOS — CID 162112968

IUPAC2-(1-methoxypropan-2-yl)-1,3-thiazole
SMILESCOCC(C)c1nccs1
InChIInChI=1S/C7H11NOS/c1-6(5-9-2)7-8-3-4-10-7/h3-4,6H,5H2,1-2H3
InChIKeyOQKMFHOWGRKYSZ-UHFFFAOYSA-N
MW157.24 g/mol
LogP1.89
Rot. Bonds3

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

2-(1-methoxypropan-2-yl)-1,3-thiazole (PubChem CID 162112968) has the molecular formula C7H11NOS and a molecular weight of 157.24 g/mol. Its IUPAC name is 2-(1-methoxypropan-2-yl)-1,3-thiazole.

Molecular Properties

Compound Name2-(1-methoxypropan-2-yl)-1,3-thiazole
PubChem CID162112968
Molecular FormulaC7H11NOS
Molecular Weight157.24 g/mol
Exact Mass157.06
IUPAC Name2-(1-methoxypropan-2-yl)-1,3-thiazole
SMILESCOCC(C)c1nccs1
InChIInChI=1S/C7H11NOS/c1-6(5-9-2)7-8-3-4-10-7/h3-4,6H,5H2,1-2H3
InChIKeyOQKMFHOWGRKYSZ-UHFFFAOYSA-N
XLogP1.89
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.24
LogP ≤ 51.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-methoxy-N-[2-(1,3-thiazol-2-yl)propyl]butan-2-amine
CID 104585087
2-(1-bromopropan-2-yl)-1,3-thiazole
CID 66470662
1-(2-methoxyethoxy)-N-[1-(1,3-thiazol-2-yl)ethyl]propan-2-amine
CID 115891943
N-(1-methoxypropan-2-yl)-1,3-thiazol-2-amine
CID 43079498
2-(1-iodoethyl)-1,3-thiazole
CID 89231680
N-[2-(1,3-thiazol-2-yl)propyl]pyrimidin-2-amine
CID 104577139
N-[(3,5-dimethoxyphenyl)methyl]-2-(1,3-thiazol-2-yl)propan-1-amine
CID 104588814
7H-benzo[c]fluorene-6-carboxylic acid;2-(1-methoxypropan-2-yl)-1,3-thiazole
CID 162112967
2-methyl-N-[2-(1,3-thiazol-2-yl)propyl]propanamide
CID 104578837
2-ethyl-N-(2-methoxyethyl)-1-(1,3-thiazol-2-yl)butan-1-amine
CID 62543117
N-ethyl-2-methoxy-N-methyl-2-(1,3-thiazol-2-yl)ethanamine
CID 176675612
N,2-dimethyl-1-(1,3-thiazol-2-yl)butan-1-amine
CID 61330921

Frequently Asked Questions

What is the IUPAC name of 2-(1-methoxypropan-2-yl)-1,3-thiazole?
The IUPAC name of 2-(1-methoxypropan-2-yl)-1,3-thiazole (CID 162112968) is 2-(1-methoxypropan-2-yl)-1,3-thiazole.
What is the SMILES notation for 2-(1-methoxypropan-2-yl)-1,3-thiazole?
The canonical SMILES for 2-(1-methoxypropan-2-yl)-1,3-thiazole is COCC(C)c1nccs1.
What is the InChIKey of 2-(1-methoxypropan-2-yl)-1,3-thiazole?
The InChIKey is OQKMFHOWGRKYSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11NOS/c1-6(5-9-2)7-8-3-4-10-7/h3-4,6H,5H2,1-2H3.
What are the key properties of 2-(1-methoxypropan-2-yl)-1,3-thiazole?
2-(1-methoxypropan-2-yl)-1,3-thiazole has a molecular weight of 157.24 g/mol, XLogP of 1.89, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-methoxypropan-2-yl)-1,3-thiazole is sourced from PubChem (CID 162112968), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).