N-(2,4-dimethylcyclohexyl)-6-methyl-1,3-benzothiazol-2-amine

C16H22N2S — CID 79142430

IUPACN-(2,4-dimethylcyclohexyl)-6-methyl-1,3-benzothiazol-2-amine
SMILESCc1ccc2nc(NC3CCC(C)CC3C)sc2c1
InChIInChI=1S/C16H22N2S/c1-10-4-6-13(12(3)8-10)17-16-18-14-7-5-11(2)9-15(14)19-16/h5,7,9-10,12-13H,4,6,8H2,1-3H3,(H,17,18)
InChIKeyRHMWMFDLHGNTQK-UHFFFAOYSA-N
MW274.43 g/mol
LogP4.84
Rot. Bonds2

About N-(2,4-dimethylcyclohexyl)-6-methyl-1,3-benzothiazol-2-amine

N-(2,4-dimethylcyclohexyl)-6-methyl-1,3-benzothiazol-2-amine (PubChem CID 79142430) has the molecular formula C16H22N2S and a molecular weight of 274.43 g/mol. Its IUPAC name is N-(2,4-dimethylcyclohexyl)-6-methyl-1,3-benzothiazol-2-amine.

Molecular Properties

Compound NameN-(2,4-dimethylcyclohexyl)-6-methyl-1,3-benzothiazol-2-amine
PubChem CID79142430
Molecular FormulaC16H22N2S
Molecular Weight274.43 g/mol
Exact Mass274.15
IUPAC NameN-(2,4-dimethylcyclohexyl)-6-methyl-1,3-benzothiazol-2-amine
SMILESCc1ccc2nc(NC3CCC(C)CC3C)sc2c1
InChIInChI=1S/C16H22N2S/c1-10-4-6-13(12(3)8-10)17-16-18-14-7-5-11(2)9-15(14)19-16/h5,7,9-10,12-13H,4,6,8H2,1-3H3,(H,17,18)
InChIKeyRHMWMFDLHGNTQK-UHFFFAOYSA-N
XLogP4.84
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.43
LogP ≤ 54.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-(2,4-dimethylcyclohexyl)-6-methyl-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-methyl-N-(2-methylcyclohexyl)-1,3-benzothiazol-2-amine
CID 78908981
N-(3,4-dimethylcyclohexyl)-6-methyl-1,3-benzothiazol-2-amine
CID 79142849
N-cycloheptyl-6-methyl-1,3-benzothiazol-2-amine
CID 78908885
6-methyl-N-(2-methyloxan-4-yl)-1,3-benzothiazol-2-amine
CID 114108893
6-methyl-N-(oxolan-3-yl)-1,3-benzothiazol-2-amine
CID 80713313
6-methoxy-N-(2-methylcyclohexyl)-1,3-benzothiazol-2-amine
CID 71628391
5-methyl-N-(2-methyloxolan-3-yl)-1,3-benzothiazol-2-amine
CID 82728861
6-methoxy-N-(2-methylcycloheptyl)-1,3-benzothiazol-2-amine
CID 79518605
5-N-(2,4-dimethylcyclohexyl)-2-methyl-1,3-benzothiazole-5,6-diamine
CID 63995855
6-methyl-N-(2,4,6-trimethylphenyl)-1,3-benzothiazol-2-amine
CID 79142410
2-N-(4-methylcyclohexyl)-1,3-benzothiazole-2,6-diamine
CID 63231366
N-(2,4-dimethylcyclohexyl)-3,5-dimethylaniline
CID 64775359

Frequently Asked Questions

What is the IUPAC name of N-(2,4-dimethylcyclohexyl)-6-methyl-1,3-benzothiazol-2-amine?
The IUPAC name of N-(2,4-dimethylcyclohexyl)-6-methyl-1,3-benzothiazol-2-amine (CID 79142430) is N-(2,4-dimethylcyclohexyl)-6-methyl-1,3-benzothiazol-2-amine.
What is the SMILES notation for N-(2,4-dimethylcyclohexyl)-6-methyl-1,3-benzothiazol-2-amine?
The canonical SMILES for N-(2,4-dimethylcyclohexyl)-6-methyl-1,3-benzothiazol-2-amine is Cc1ccc2nc(NC3CCC(C)CC3C)sc2c1.
What is the InChIKey of N-(2,4-dimethylcyclohexyl)-6-methyl-1,3-benzothiazol-2-amine?
The InChIKey is RHMWMFDLHGNTQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N2S/c1-10-4-6-13(12(3)8-10)17-16-18-14-7-5-11(2)9-15(14)19-16/h5,7,9-10,12-13H,4,6,8H2,1-3H3,(H,17,18).
What are the key properties of N-(2,4-dimethylcyclohexyl)-6-methyl-1,3-benzothiazol-2-amine?
N-(2,4-dimethylcyclohexyl)-6-methyl-1,3-benzothiazol-2-amine has a molecular weight of 274.43 g/mol, XLogP of 4.84, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-dimethylcyclohexyl)-6-methyl-1,3-benzothiazol-2-amine is sourced from PubChem (CID 79142430), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).