4-(thiophen-2-ylmethoxy)-1,2-thiazole

C8H7NOS2 — CID 54266344

IUPAC4-(thiophen-2-ylmethoxy)-1,2-thiazole
SMILESc1csc(COc2cnsc2)c1
InChIInChI=1S/C8H7NOS2/c1-2-8(11-3-1)5-10-7-4-9-12-6-7/h1-4,6H,5H2
InChIKeyIFQRMIMITYUZPD-UHFFFAOYSA-N
MW197.28 g/mol
LogP2.78
Rot. Bonds3

About 4-(thiophen-2-ylmethoxy)-1,2-thiazole

4-(thiophen-2-ylmethoxy)-1,2-thiazole (PubChem CID 54266344) has the molecular formula C8H7NOS2 and a molecular weight of 197.28 g/mol. Its IUPAC name is 4-(thiophen-2-ylmethoxy)-1,2-thiazole.

Molecular Properties

Compound Name4-(thiophen-2-ylmethoxy)-1,2-thiazole
PubChem CID54266344
Molecular FormulaC8H7NOS2
Molecular Weight197.28 g/mol
Exact Mass197.00
IUPAC Name4-(thiophen-2-ylmethoxy)-1,2-thiazole
SMILESc1csc(COc2cnsc2)c1
InChIInChI=1S/C8H7NOS2/c1-2-8(11-3-1)5-10-7-4-9-12-6-7/h1-4,6H,5H2
InChIKeyIFQRMIMITYUZPD-UHFFFAOYSA-N
XLogP2.78
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.28
LogP ≤ 52.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2-[5-(thiophen-2-ylmethoxy)-2-pyridinyl]ethanamine
CID 79800061
3-(thiophen-2-ylmethoxy)phenol
CID 43143563
2-[[4-(bromomethyl)phenoxy]methyl]thiophene
CID 43141545
[4-(thiophen-2-ylmethoxy)-2-pyridinyl]methanamine
CID 62321392
N-methyl-4-(thiophen-2-ylmethoxy)aniline
CID 61027856
2-[2-[3,5-bis(thiophen-2-ylmethoxy)phenyl]ethyl]thiophene
CID 135169401
1,2-thiazol-4-yloxymethanamine
CID 117230046
5-(thiophen-2-ylmethoxy)pyridine-3-carboxylic acid
CID 63851353
(1R)-1-[5-(thiophen-2-ylmethoxy)-2-pyridinyl]propan-1-amine
CID 103937928
5-(thiophen-2-ylmethoxy)-1H-indole
CID 18797477
5-methyl-6-(thiophen-2-ylmethoxy)pyridin-3-amine
CID 62475410
methyl-[[4-(thiophen-2-ylmethoxy)phenyl]methyl]azanium
CID 7827460

Frequently Asked Questions

What is the IUPAC name of 4-(thiophen-2-ylmethoxy)-1,2-thiazole?
The IUPAC name of 4-(thiophen-2-ylmethoxy)-1,2-thiazole (CID 54266344) is 4-(thiophen-2-ylmethoxy)-1,2-thiazole.
What is the SMILES notation for 4-(thiophen-2-ylmethoxy)-1,2-thiazole?
The canonical SMILES for 4-(thiophen-2-ylmethoxy)-1,2-thiazole is c1csc(COc2cnsc2)c1.
What is the InChIKey of 4-(thiophen-2-ylmethoxy)-1,2-thiazole?
The InChIKey is IFQRMIMITYUZPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H7NOS2/c1-2-8(11-3-1)5-10-7-4-9-12-6-7/h1-4,6H,5H2.
What are the key properties of 4-(thiophen-2-ylmethoxy)-1,2-thiazole?
4-(thiophen-2-ylmethoxy)-1,2-thiazole has a molecular weight of 197.28 g/mol, XLogP of 2.78, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(thiophen-2-ylmethoxy)-1,2-thiazole is sourced from PubChem (CID 54266344), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).