2-methoxy-N-(6-methyl-1,3-benzothiazol-2-yl)acetamide

C11H12N2O2S — CID 836502

IUPAC2-methoxy-N-(6-methyl-1,3-benzothiazol-2-yl)acetamide
SMILESCOCC(=O)Nc1nc2ccc(C)cc2s1
InChIInChI=1S/C11H12N2O2S/c1-7-3-4-8-9(5-7)16-11(12-8)13-10(14)6-15-2/h3-5H,6H2,1-2H3,(H,12,13,14)
InChIKeyJLUTZYYSFNIMIN-UHFFFAOYSA-N
MW236.30 g/mol
LogP2.19
Rot. Bonds3

About 2-methoxy-N-(6-methyl-1,3-benzothiazol-2-yl)acetamide

2-methoxy-N-(6-methyl-1,3-benzothiazol-2-yl)acetamide (PubChem CID 836502) has the molecular formula C11H12N2O2S and a molecular weight of 236.30 g/mol. Its IUPAC name is 2-methoxy-N-(6-methyl-1,3-benzothiazol-2-yl)acetamide.

Molecular Properties

Compound Name2-methoxy-N-(6-methyl-1,3-benzothiazol-2-yl)acetamide
PubChem CID836502
Molecular FormulaC11H12N2O2S
Molecular Weight236.30 g/mol
Exact Mass236.06
IUPAC Name2-methoxy-N-(6-methyl-1,3-benzothiazol-2-yl)acetamide
SMILESCOCC(=O)Nc1nc2ccc(C)cc2s1
InChIInChI=1S/C11H12N2O2S/c1-7-3-4-8-9(5-7)16-11(12-8)13-10(14)6-15-2/h3-5H,6H2,1-2H3,(H,12,13,14)
InChIKeyJLUTZYYSFNIMIN-UHFFFAOYSA-N
XLogP2.19
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.30
LogP ≤ 52.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-methoxy-N-(6-methyl-1,3-benzothiazol-2-yl)acetamide with MolForge

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

Launch Full Analysis

Related Compounds

methyl 4-[(6-methyl-1,3-benzothiazol-2-yl)amino]-4-oxobutanoate
CID 110756987
2-(2,4-dimethylphenoxy)-N-(6-methyl-1,3-benzothiazol-2-yl)acetamide
CID 836392
[2-[(6-methyl-1,3-benzothiazol-2-yl)amino]-2-oxoethyl] 3,5-dimethoxybenzoate
CID 23742164
[2-[(6-methyl-1,3-benzothiazol-2-yl)amino]-2-oxoethyl] (2R)-2-methylpentanoate
CID 2357128
[2-[(6-methyl-1,3-benzothiazol-2-yl)amino]-2-oxoethyl] 2-hydroxy-2-phenylacetate
CID 23828313
2-(3-acetylphenoxy)-N-(6-methyl-1,3-benzothiazol-2-yl)acetamide
CID 2701448
N-(6-methyl-1,3-benzothiazol-2-yl)-2-(4-propanoylphenoxy)acetamide
CID 7919939
N-(6-methyl-1,3-benzothiazol-2-yl)-2-[(4-methylphenyl)methylsulfanyl]acetamide
CID 16545610
N-(6-methoxy-1,3-benzothiazol-2-yl)-2-[4-(4-methylphenyl)phenoxy]acetamide
CID 19173855
2-(3-acetamidophenoxy)-N-(6-methyl-1,3-benzothiazol-2-yl)acetamide
CID 18870050
[2-[(6-methyl-1,3-benzothiazol-2-yl)amino]-2-oxoethyl] 2-(3,4-dimethoxyphenyl)acetate
CID 2448233
2-methoxy-N-[6-(morpholin-4-ylmethyl)-1,3-benzothiazol-2-yl]acetamide
CID 108740900

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-(6-methyl-1,3-benzothiazol-2-yl)acetamide?
The IUPAC name of 2-methoxy-N-(6-methyl-1,3-benzothiazol-2-yl)acetamide (CID 836502) is 2-methoxy-N-(6-methyl-1,3-benzothiazol-2-yl)acetamide.
What is the SMILES notation for 2-methoxy-N-(6-methyl-1,3-benzothiazol-2-yl)acetamide?
The canonical SMILES for 2-methoxy-N-(6-methyl-1,3-benzothiazol-2-yl)acetamide is COCC(=O)Nc1nc2ccc(C)cc2s1.
What is the InChIKey of 2-methoxy-N-(6-methyl-1,3-benzothiazol-2-yl)acetamide?
The InChIKey is JLUTZYYSFNIMIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N2O2S/c1-7-3-4-8-9(5-7)16-11(12-8)13-10(14)6-15-2/h3-5H,6H2,1-2H3,(H,12,13,14).
What are the key properties of 2-methoxy-N-(6-methyl-1,3-benzothiazol-2-yl)acetamide?
2-methoxy-N-(6-methyl-1,3-benzothiazol-2-yl)acetamide has a molecular weight of 236.30 g/mol, XLogP of 2.19, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-(6-methyl-1,3-benzothiazol-2-yl)acetamide is sourced from PubChem (CID 836502), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).