4-(2-methylpropoxy)-1,2-thiazole

C7H11NOS — CID 117233613

IUPAC4-(2-methylpropoxy)-1,2-thiazole
SMILESCC(C)COc1cnsc1
InChIInChI=1S/C7H11NOS/c1-6(2)4-9-7-3-8-10-5-7/h3,5-6H,4H2,1-2H3
InChIKeyKRIMTFFRIRZJIO-UHFFFAOYSA-N
MW157.24 g/mol
LogP2.18
Rot. Bonds3

About 4-(2-methylpropoxy)-1,2-thiazole

4-(2-methylpropoxy)-1,2-thiazole (PubChem CID 117233613) has the molecular formula C7H11NOS and a molecular weight of 157.24 g/mol. Its IUPAC name is 4-(2-methylpropoxy)-1,2-thiazole.

Molecular Properties

Compound Name4-(2-methylpropoxy)-1,2-thiazole
PubChem CID117233613
Molecular FormulaC7H11NOS
Molecular Weight157.24 g/mol
Exact Mass157.06
IUPAC Name4-(2-methylpropoxy)-1,2-thiazole
SMILESCC(C)COc1cnsc1
InChIInChI=1S/C7H11NOS/c1-6(2)4-9-7-3-8-10-5-7/h3,5-6H,4H2,1-2H3
InChIKeyKRIMTFFRIRZJIO-UHFFFAOYSA-N
XLogP2.18
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 ≤ 52.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-(1,2-thiazol-4-yloxy)ethanamine
CID 117230048
5-(2-methylpropoxy)pyrimidine
CID 58125465
[5-(2-methylpropoxy)-2-pyridinyl]methanamine
CID 79787202
2-methyl-1-[4-(2-methylpropoxy)phenyl]propan-2-amine
CID 95444849
4-[4-(2-methylpropoxy)phenyl]thiophen-2-amine
CID 82479976
1-(2-methylpropoxy)-4-[4-(2-methylpropoxy)phenyl]sulfonylbenzene
CID 22131571
N-methyl-1-[5-(2-methylpropoxy)-2-pyridinyl]methanamine
CID 79775957
2-[4-(2-methylpropoxy)phenyl]propan-2-amine
CID 50988085
4-(2-methylpropoxy)-N-(2-methylpropyl)aniline
CID 83946363
N-methyl-1-[5-(2-methylpropoxy)-2-pyridinyl]ethanamine
CID 83127836
2-[5-(2-methylpropoxy)-2-pyridinyl]ethanamine
CID 79799793
5-iodo-2-(2-methylpropoxy)pyrimidine
CID 116649140

Frequently Asked Questions

What is the IUPAC name of 4-(2-methylpropoxy)-1,2-thiazole?
The IUPAC name of 4-(2-methylpropoxy)-1,2-thiazole (CID 117233613) is 4-(2-methylpropoxy)-1,2-thiazole.
What is the SMILES notation for 4-(2-methylpropoxy)-1,2-thiazole?
The canonical SMILES for 4-(2-methylpropoxy)-1,2-thiazole is CC(C)COc1cnsc1.
What is the InChIKey of 4-(2-methylpropoxy)-1,2-thiazole?
The InChIKey is KRIMTFFRIRZJIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11NOS/c1-6(2)4-9-7-3-8-10-5-7/h3,5-6H,4H2,1-2H3.
What are the key properties of 4-(2-methylpropoxy)-1,2-thiazole?
4-(2-methylpropoxy)-1,2-thiazole has a molecular weight of 157.24 g/mol, XLogP of 2.18, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-methylpropoxy)-1,2-thiazole is sourced from PubChem (CID 117233613), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).