5-methyl-N-(1-thiophen-3-ylpropan-2-yl)-1,3-benzothiazol-2-amine

C15H16N2S2 — CID 63545519

IUPAC5-methyl-N-(1-thiophen-3-ylpropan-2-yl)-1,3-benzothiazol-2-amine
SMILESCc1ccc2sc(NC(C)Cc3ccsc3)nc2c1
InChIInChI=1S/C15H16N2S2/c1-10-3-4-14-13(7-10)17-15(19-14)16-11(2)8-12-5-6-18-9-12/h3-7,9,11H,8H2,1-2H3,(H,16,17)
InChIKeyZAHFWVIWUWTKOM-UHFFFAOYSA-N
MW288.44 g/mol
LogP4.71
Rot. Bonds4

About 5-methyl-N-(1-thiophen-3-ylpropan-2-yl)-1,3-benzothiazol-2-amine

5-methyl-N-(1-thiophen-3-ylpropan-2-yl)-1,3-benzothiazol-2-amine (PubChem CID 63545519) has the molecular formula C15H16N2S2 and a molecular weight of 288.44 g/mol. Its IUPAC name is 5-methyl-N-(1-thiophen-3-ylpropan-2-yl)-1,3-benzothiazol-2-amine.

Molecular Properties

Compound Name5-methyl-N-(1-thiophen-3-ylpropan-2-yl)-1,3-benzothiazol-2-amine
PubChem CID63545519
Molecular FormulaC15H16N2S2
Molecular Weight288.44 g/mol
Exact Mass288.08
IUPAC Name5-methyl-N-(1-thiophen-3-ylpropan-2-yl)-1,3-benzothiazol-2-amine
SMILESCc1ccc2sc(NC(C)Cc3ccsc3)nc2c1
InChIInChI=1S/C15H16N2S2/c1-10-3-4-14-13(7-10)17-15(19-14)16-11(2)8-12-5-6-18-9-12/h3-7,9,11H,8H2,1-2H3,(H,16,17)
InChIKeyZAHFWVIWUWTKOM-UHFFFAOYSA-N
XLogP4.71
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.44
LogP ≤ 54.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 5-methyl-N-(1-thiophen-3-ylpropan-2-yl)-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

Related Compounds

6-bromo-N-(1-thiophen-3-ylpropan-2-yl)-1,3-benzothiazol-2-amine
CID 79527738
2-N-(1-thiophen-3-ylpropan-2-yl)-1,3-benzothiazole-2,6-diamine
CID 63231055
5-methyl-2-(1-thiophen-3-ylpropan-2-ylamino)benzoic acid
CID 62516052
N-[1-(4-methoxyphenyl)ethyl]-5-methyl-1,3-benzothiazol-2-amine
CID 66241808
2-ethyl-6-N-methyl-4-N-(1-thiophen-3-ylpropan-2-yl)pyrimidine-4,6-diamine
CID 80934504
6-methyl-N-(1-thiophen-3-ylpropan-2-yl)pyridin-3-amine
CID 115921558
2,6-dimethyl-N-(1-thiophen-3-ylpropan-2-yl)quinoline-4-carboxamide
CID 55974194
6-methyl-4-N-(1-thiophen-3-ylpropan-2-yl)thieno[2,3-d]pyrimidine-2,4-diamine
CID 103326002
2-methyl-4-N-(1-thiophen-3-ylpropan-2-yl)-1H-imidazole-4,5-diamine
CID 82239190
3,5-dichloro-2-N-methyl-6-N-(1-thiophen-3-ylpropan-2-yl)pyridine-2,6-diamine
CID 102756935
5-methyl-2-[1-(1-thiophen-3-ylpropan-2-ylamino)ethyl]phenol
CID 61473528
N-(1-thiophen-3-ylpropan-2-yl)quinazolin-2-amine
CID 114788976

Frequently Asked Questions

What is the IUPAC name of 5-methyl-N-(1-thiophen-3-ylpropan-2-yl)-1,3-benzothiazol-2-amine?
The IUPAC name of 5-methyl-N-(1-thiophen-3-ylpropan-2-yl)-1,3-benzothiazol-2-amine (CID 63545519) is 5-methyl-N-(1-thiophen-3-ylpropan-2-yl)-1,3-benzothiazol-2-amine.
What is the SMILES notation for 5-methyl-N-(1-thiophen-3-ylpropan-2-yl)-1,3-benzothiazol-2-amine?
The canonical SMILES for 5-methyl-N-(1-thiophen-3-ylpropan-2-yl)-1,3-benzothiazol-2-amine is Cc1ccc2sc(NC(C)Cc3ccsc3)nc2c1.
What is the InChIKey of 5-methyl-N-(1-thiophen-3-ylpropan-2-yl)-1,3-benzothiazol-2-amine?
The InChIKey is ZAHFWVIWUWTKOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2S2/c1-10-3-4-14-13(7-10)17-15(19-14)16-11(2)8-12-5-6-18-9-12/h3-7,9,11H,8H2,1-2H3,(H,16,17).
What are the key properties of 5-methyl-N-(1-thiophen-3-ylpropan-2-yl)-1,3-benzothiazol-2-amine?
5-methyl-N-(1-thiophen-3-ylpropan-2-yl)-1,3-benzothiazol-2-amine has a molecular weight of 288.44 g/mol, XLogP of 4.71, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-N-(1-thiophen-3-ylpropan-2-yl)-1,3-benzothiazol-2-amine is sourced from PubChem (CID 63545519), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).