4-methoxy-2-propyl-1,3-thiazole

C7H11NOS — CID 91805353

IUPAC4-methoxy-2-propyl-1,3-thiazole
SMILESCCCc1nc(OC)cs1
InChIInChI=1S/C7H11NOS/c1-3-4-7-8-6(9-2)5-10-7/h5H,3-4H2,1-2H3
InChIKeyUTESSPRAJPQGQL-UHFFFAOYSA-N
MW157.24 g/mol
LogP2.10
Rot. Bonds3

About 4-methoxy-2-propyl-1,3-thiazole

4-methoxy-2-propyl-1,3-thiazole (PubChem CID 91805353) has the molecular formula C7H11NOS and a molecular weight of 157.24 g/mol. Its IUPAC name is 4-methoxy-2-propyl-1,3-thiazole.

Molecular Properties

Compound Name4-methoxy-2-propyl-1,3-thiazole
PubChem CID91805353
Molecular FormulaC7H11NOS
Molecular Weight157.24 g/mol
Exact Mass157.06
IUPAC Name4-methoxy-2-propyl-1,3-thiazole
SMILESCCCc1nc(OC)cs1
InChIInChI=1S/C7H11NOS/c1-3-4-7-8-6(9-2)5-10-7/h5H,3-4H2,1-2H3
InChIKeyUTESSPRAJPQGQL-UHFFFAOYSA-N
XLogP2.10
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 ≤ 52.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-Ethynyl-4-methoxy-1,3-thiazole
CID 45079318
2-Ethyl-4-thiazolol
CID 45787996
Methoxy-ethyl-thiazole
CID 68251462
2-Fluoro-4-methoxy-1,3-thiazole
CID 19841673
2-Methyl-4-(trifluoromethoxy)-1,3-thiazole
CID 118466329
2-Propan-2-yl-4-(trifluoromethoxy)-1,3-thiazole
CID 144946103
4-Methoxy-2-(trifluoromethyl)-1,3-thiazole
CID 174599117
2-(2-Fluoropropan-2-yl)-1,3-thiazol-4-ol
CID 84764356
2-Chloro-4-methoxy-1,3-thiazole
CID 19871495
2,4-Dimethoxythiazole
CID 22342547
4-Methoxy-2-(2-methylpropyl)-1,3-thiazole
CID 22758950
Thiazole, 4-methoxy-2-methyl-
CID 45121779

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-2-propyl-1,3-thiazole?
The IUPAC name of 4-methoxy-2-propyl-1,3-thiazole (CID 91805353) is 4-methoxy-2-propyl-1,3-thiazole.
What is the SMILES notation for 4-methoxy-2-propyl-1,3-thiazole?
The canonical SMILES for 4-methoxy-2-propyl-1,3-thiazole is CCCc1nc(OC)cs1.
What is the InChIKey of 4-methoxy-2-propyl-1,3-thiazole?
The InChIKey is UTESSPRAJPQGQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11NOS/c1-3-4-7-8-6(9-2)5-10-7/h5H,3-4H2,1-2H3.
What are the key properties of 4-methoxy-2-propyl-1,3-thiazole?
4-methoxy-2-propyl-1,3-thiazole has a molecular weight of 157.24 g/mol, XLogP of 2.10, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-2-propyl-1,3-thiazole is sourced from PubChem (CID 91805353), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).