5-methyl-2-propoxy-1,3-thiazole

C7H11NOS — CID 143895190

IUPAC5-methyl-2-propoxy-1,3-thiazole
SMILESCCCOc1ncc(C)s1
InChIInChI=1S/C7H11NOS/c1-3-4-9-7-8-5-6(2)10-7/h5H,3-4H2,1-2H3
InChIKeyPFVUGHSVVKWCDJ-UHFFFAOYSA-N
MW157.24 g/mol
LogP2.24
Rot. Bonds3

About 5-methyl-2-propoxy-1,3-thiazole

5-methyl-2-propoxy-1,3-thiazole (PubChem CID 143895190) has the molecular formula C7H11NOS and a molecular weight of 157.24 g/mol. Its IUPAC name is 5-methyl-2-propoxy-1,3-thiazole.

Molecular Properties

Compound Name5-methyl-2-propoxy-1,3-thiazole
PubChem CID143895190
Molecular FormulaC7H11NOS
Molecular Weight157.24 g/mol
Exact Mass157.06
IUPAC Name5-methyl-2-propoxy-1,3-thiazole
SMILESCCCOc1ncc(C)s1
InChIInChI=1S/C7H11NOS/c1-3-4-9-7-8-5-6(2)10-7/h5H,3-4H2,1-2H3
InChIKeyPFVUGHSVVKWCDJ-UHFFFAOYSA-N
XLogP2.24
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 ≤ 52.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-methyl-2-propoxy-1,3-thiazole?
The IUPAC name of 5-methyl-2-propoxy-1,3-thiazole (CID 143895190) is 5-methyl-2-propoxy-1,3-thiazole.
What is the SMILES notation for 5-methyl-2-propoxy-1,3-thiazole?
The canonical SMILES for 5-methyl-2-propoxy-1,3-thiazole is CCCOc1ncc(C)s1.
What is the InChIKey of 5-methyl-2-propoxy-1,3-thiazole?
The InChIKey is PFVUGHSVVKWCDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11NOS/c1-3-4-9-7-8-5-6(2)10-7/h5H,3-4H2,1-2H3.
What are the key properties of 5-methyl-2-propoxy-1,3-thiazole?
5-methyl-2-propoxy-1,3-thiazole has a molecular weight of 157.24 g/mol, XLogP of 2.24, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-2-propoxy-1,3-thiazole is sourced from PubChem (CID 143895190), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).