6-ethoxy-1,3-benzothiazol-2-amine

C9H10N2OS — CID 7192

IUPAC6-ethoxy-1,3-benzothiazol-2-amine
SMILESCCOc1ccc2nc(N)sc2c1
InChIInChI=1S/C9H10N2OS/c1-2-12-6-3-4-7-8(5-6)13-9(10)11-7/h3-5H,2H2,1H3,(H2,10,11)
InChIKeyKOYJWFGMEBETBU-UHFFFAOYSA-N
MW194.26 g/mol
LogP2.28
Rot. Bonds2

About 6-ethoxy-1,3-benzothiazol-2-amine

6-ethoxy-1,3-benzothiazol-2-amine (PubChem CID 7192) has the molecular formula C9H10N2OS and a molecular weight of 194.26 g/mol. Its IUPAC name is 6-ethoxy-1,3-benzothiazol-2-amine.

Molecular Properties

Compound Name6-ethoxy-1,3-benzothiazol-2-amine
PubChem CID7192
Molecular FormulaC9H10N2OS
Molecular Weight194.26 g/mol
Exact Mass194.05
IUPAC Name6-ethoxy-1,3-benzothiazol-2-amine
SMILESCCOc1ccc2nc(N)sc2c1
InChIInChI=1S/C9H10N2OS/c1-2-12-6-3-4-7-8(5-6)13-9(10)11-7/h3-5H,2H2,1H3,(H2,10,11)
InChIKeyKOYJWFGMEBETBU-UHFFFAOYSA-N
XLogP2.28
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.26
LogP ≤ 52.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 6-ethoxy-1,3-benzothiazol-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 6-ethoxy-1,3-benzothiazol-2-amine?
The IUPAC name of 6-ethoxy-1,3-benzothiazol-2-amine (CID 7192) is 6-ethoxy-1,3-benzothiazol-2-amine.
What is the SMILES notation for 6-ethoxy-1,3-benzothiazol-2-amine?
The canonical SMILES for 6-ethoxy-1,3-benzothiazol-2-amine is CCOc1ccc2nc(N)sc2c1.
What is the InChIKey of 6-ethoxy-1,3-benzothiazol-2-amine?
The InChIKey is KOYJWFGMEBETBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10N2OS/c1-2-12-6-3-4-7-8(5-6)13-9(10)11-7/h3-5H,2H2,1H3,(H2,10,11).
What are the key properties of 6-ethoxy-1,3-benzothiazol-2-amine?
6-ethoxy-1,3-benzothiazol-2-amine has a molecular weight of 194.26 g/mol, XLogP of 2.28, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethoxy-1,3-benzothiazol-2-amine is sourced from PubChem (CID 7192), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).