6,7-dimethoxy-4H-indeno[1,2-d][1,3]thiazol-2-amine

C12H12N2O2S — CID 10292900

IUPAC6,7-dimethoxy-4H-indeno[1,2-d][1,3]thiazol-2-amine
SMILESCOc1cc2c(cc1OC)-c1nc(N)sc1C2
InChIInChI=1S/C12H12N2O2S/c1-15-8-3-6-4-10-11(14-12(13)17-10)7(6)5-9(8)16-2/h3,5H,4H2,1-2H3,(H2,13,14)
InChIKeyJDLASYBOMHXKPM-UHFFFAOYSA-N
MW248.31 g/mol
LogP2.31
Rot. Bonds2

About 6,7-dimethoxy-4H-indeno[1,2-d][1,3]thiazol-2-amine

6,7-dimethoxy-4H-indeno[1,2-d][1,3]thiazol-2-amine (PubChem CID 10292900) has the molecular formula C12H12N2O2S and a molecular weight of 248.31 g/mol. Its IUPAC name is 6,7-dimethoxy-4H-indeno[1,2-d][1,3]thiazol-2-amine.

Molecular Properties

Compound Name6,7-dimethoxy-4H-indeno[1,2-d][1,3]thiazol-2-amine
PubChem CID10292900
Molecular FormulaC12H12N2O2S
Molecular Weight248.31 g/mol
Exact Mass248.06
IUPAC Name6,7-dimethoxy-4H-indeno[1,2-d][1,3]thiazol-2-amine
SMILESCOc1cc2c(cc1OC)-c1nc(N)sc1C2
InChIInChI=1S/C12H12N2O2S/c1-15-8-3-6-4-10-11(14-12(13)17-10)7(6)5-9(8)16-2/h3,5H,4H2,1-2H3,(H2,13,14)
InChIKeyJDLASYBOMHXKPM-UHFFFAOYSA-N
XLogP2.31
TPSA57.37 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.31
LogP ≤ 52.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6,7-dimethoxy-4H-indeno[1,2-d][1,3]thiazol-2-amine?
The IUPAC name of 6,7-dimethoxy-4H-indeno[1,2-d][1,3]thiazol-2-amine (CID 10292900) is 6,7-dimethoxy-4H-indeno[1,2-d][1,3]thiazol-2-amine.
What is the SMILES notation for 6,7-dimethoxy-4H-indeno[1,2-d][1,3]thiazol-2-amine?
The canonical SMILES for 6,7-dimethoxy-4H-indeno[1,2-d][1,3]thiazol-2-amine is COc1cc2c(cc1OC)-c1nc(N)sc1C2.
What is the InChIKey of 6,7-dimethoxy-4H-indeno[1,2-d][1,3]thiazol-2-amine?
The InChIKey is JDLASYBOMHXKPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12N2O2S/c1-15-8-3-6-4-10-11(14-12(13)17-10)7(6)5-9(8)16-2/h3,5H,4H2,1-2H3,(H2,13,14).
What are the key properties of 6,7-dimethoxy-4H-indeno[1,2-d][1,3]thiazol-2-amine?
6,7-dimethoxy-4H-indeno[1,2-d][1,3]thiazol-2-amine has a molecular weight of 248.31 g/mol, XLogP of 2.31, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6,7-dimethoxy-4H-indeno[1,2-d][1,3]thiazol-2-amine is sourced from PubChem (CID 10292900), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).