6-ethoxy-N-(1-methylcyclohexyl)-1,3-benzothiazol-2-amine

C16H22N2OS — CID 79518738

IUPAC6-ethoxy-N-(1-methylcyclohexyl)-1,3-benzothiazol-2-amine
SMILESCCOc1ccc2nc(NC3(C)CCCCC3)sc2c1
InChIInChI=1S/C16H22N2OS/c1-3-19-12-7-8-13-14(11-12)20-15(17-13)18-16(2)9-5-4-6-10-16/h7-8,11H,3-6,9-10H2,1-2H3,(H,17,18)
InChIKeyYYNQDZSXPLUSAA-UHFFFAOYSA-N
MW290.43 g/mol
LogP4.83
Rot. Bonds4

About 6-ethoxy-N-(1-methylcyclohexyl)-1,3-benzothiazol-2-amine

6-ethoxy-N-(1-methylcyclohexyl)-1,3-benzothiazol-2-amine (PubChem CID 79518738) has the molecular formula C16H22N2OS and a molecular weight of 290.43 g/mol. Its IUPAC name is 6-ethoxy-N-(1-methylcyclohexyl)-1,3-benzothiazol-2-amine.

Molecular Properties

Compound Name6-ethoxy-N-(1-methylcyclohexyl)-1,3-benzothiazol-2-amine
PubChem CID79518738
Molecular FormulaC16H22N2OS
Molecular Weight290.43 g/mol
Exact Mass290.15
IUPAC Name6-ethoxy-N-(1-methylcyclohexyl)-1,3-benzothiazol-2-amine
SMILESCCOc1ccc2nc(NC3(C)CCCCC3)sc2c1
InChIInChI=1S/C16H22N2OS/c1-3-19-12-7-8-13-14(11-12)20-15(17-13)18-16(2)9-5-4-6-10-16/h7-8,11H,3-6,9-10H2,1-2H3,(H,17,18)
InChIKeyYYNQDZSXPLUSAA-UHFFFAOYSA-N
XLogP4.83
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.43
LogP ≤ 54.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 6-ethoxy-N-(1-methylcyclohexyl)-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-ethoxy-N-[1-(trifluoromethyl)cyclopropyl]-1,3-benzothiazol-2-amine
CID 106219318
1-cyano-N-(6-ethoxy-1,3-benzothiazol-2-yl)cyclohexane-1-carboxamide
CID 60581755
N-(6-ethoxy-1,3-benzothiazol-2-yl)-1-phenylcyclopentane-1-carboxamide
CID 25239419
N-cyclopropyl-6-ethoxy-1,3-benzothiazol-2-amine
CID 78908969
N-(6-ethoxy-1,3-benzothiazol-2-yl)-3-methylpiperidine-3-carboxamide;hydrochloride
CID 119943598
N-(6-ethoxy-1,3-benzothiazol-2-yl)-1-phenylcyclopropane-1-carboxamide
CID 2528625
N-(6-ethoxy-1,3-benzothiazol-2-yl)-6-ethyl-1,3-benzothiazol-2-amine
CID 108779484
1-cyclohexyl-3-(6-ethoxy-1,3-benzothiazol-2-yl)thiourea
CID 3458373
2,2-dichloro-N-(6-ethoxy-1,3-benzothiazol-2-yl)-1-methylcyclopropane-1-carboxamide
CID 46665582
N-(1,1-dioxothiolan-3-yl)-6-ethoxy-1,3-benzothiazol-2-amine
CID 79518186
N'-(6-ethoxy-1,3-benzothiazol-2-yl)propane-1,3-diamine
CID 82191696
6-ethoxy-N-(oxan-4-yl)-1,3-benzothiazol-2-amine
CID 79518870

Frequently Asked Questions

What is the IUPAC name of 6-ethoxy-N-(1-methylcyclohexyl)-1,3-benzothiazol-2-amine?
The IUPAC name of 6-ethoxy-N-(1-methylcyclohexyl)-1,3-benzothiazol-2-amine (CID 79518738) is 6-ethoxy-N-(1-methylcyclohexyl)-1,3-benzothiazol-2-amine.
What is the SMILES notation for 6-ethoxy-N-(1-methylcyclohexyl)-1,3-benzothiazol-2-amine?
The canonical SMILES for 6-ethoxy-N-(1-methylcyclohexyl)-1,3-benzothiazol-2-amine is CCOc1ccc2nc(NC3(C)CCCCC3)sc2c1.
What is the InChIKey of 6-ethoxy-N-(1-methylcyclohexyl)-1,3-benzothiazol-2-amine?
The InChIKey is YYNQDZSXPLUSAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N2OS/c1-3-19-12-7-8-13-14(11-12)20-15(17-13)18-16(2)9-5-4-6-10-16/h7-8,11H,3-6,9-10H2,1-2H3,(H,17,18).
What are the key properties of 6-ethoxy-N-(1-methylcyclohexyl)-1,3-benzothiazol-2-amine?
6-ethoxy-N-(1-methylcyclohexyl)-1,3-benzothiazol-2-amine has a molecular weight of 290.43 g/mol, XLogP of 4.83, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethoxy-N-(1-methylcyclohexyl)-1,3-benzothiazol-2-amine is sourced from PubChem (CID 79518738), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).