6-methoxy-4H-indeno[2,1-d][1,3]thiazole

C11H9NOS — CID 172548294

IUPAC6-methoxy-4H-indeno[2,1-d][1,3]thiazole
SMILESCOc1ccc2c(c1)Cc1ncsc1-2
InChIInChI=1S/C11H9NOS/c1-13-8-2-3-9-7(4-8)5-10-11(9)14-6-12-10/h2-4,6H,5H2,1H3
InChIKeyOEAOEZPTXGCSBE-UHFFFAOYSA-N
MW203.27 g/mol
LogP2.72
Rot. Bonds1

About 6-methoxy-4H-indeno[2,1-d][1,3]thiazole

6-methoxy-4H-indeno[2,1-d][1,3]thiazole (PubChem CID 172548294) has the molecular formula C11H9NOS and a molecular weight of 203.27 g/mol. Its IUPAC name is 6-methoxy-4H-indeno[2,1-d][1,3]thiazole.

Molecular Properties

Compound Name6-methoxy-4H-indeno[2,1-d][1,3]thiazole
PubChem CID172548294
Molecular FormulaC11H9NOS
Molecular Weight203.27 g/mol
Exact Mass203.04
IUPAC Name6-methoxy-4H-indeno[2,1-d][1,3]thiazole
SMILESCOc1ccc2c(c1)Cc1ncsc1-2
InChIInChI=1S/C11H9NOS/c1-13-8-2-3-9-7(4-8)5-10-11(9)14-6-12-10/h2-4,6H,5H2,1H3
InChIKeyOEAOEZPTXGCSBE-UHFFFAOYSA-N
XLogP2.72
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.27
LogP ≤ 52.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-methoxy-4H-indeno[2,1-d][1,3]thiazole?
The IUPAC name of 6-methoxy-4H-indeno[2,1-d][1,3]thiazole (CID 172548294) is 6-methoxy-4H-indeno[2,1-d][1,3]thiazole.
What is the SMILES notation for 6-methoxy-4H-indeno[2,1-d][1,3]thiazole?
The canonical SMILES for 6-methoxy-4H-indeno[2,1-d][1,3]thiazole is COc1ccc2c(c1)Cc1ncsc1-2.
What is the InChIKey of 6-methoxy-4H-indeno[2,1-d][1,3]thiazole?
The InChIKey is OEAOEZPTXGCSBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9NOS/c1-13-8-2-3-9-7(4-8)5-10-11(9)14-6-12-10/h2-4,6H,5H2,1H3.
What are the key properties of 6-methoxy-4H-indeno[2,1-d][1,3]thiazole?
6-methoxy-4H-indeno[2,1-d][1,3]thiazole has a molecular weight of 203.27 g/mol, XLogP of 2.72, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-4H-indeno[2,1-d][1,3]thiazole is sourced from PubChem (CID 172548294), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).