5-N-(3,5-dimethylcyclohexyl)-1,2-thiazole-3,5-diamine

C11H19N3S — CID 103359753

IUPAC5-N-(3,5-dimethylcyclohexyl)-1,2-thiazole-3,5-diamine
SMILESCC1CC(C)CC(Nc2cc(N)ns2)C1
InChIInChI=1S/C11H19N3S/c1-7-3-8(2)5-9(4-7)13-11-6-10(12)14-15-11/h6-9,13H,3-5H2,1-2H3,(H2,12,14)
InChIKeyDLSANHXFTWTURM-UHFFFAOYSA-N
MW225.36 g/mol
LogP2.96
Rot. Bonds2

About 5-N-(3,5-dimethylcyclohexyl)-1,2-thiazole-3,5-diamine

5-N-(3,5-dimethylcyclohexyl)-1,2-thiazole-3,5-diamine (PubChem CID 103359753) has the molecular formula C11H19N3S and a molecular weight of 225.36 g/mol. Its IUPAC name is 5-N-(3,5-dimethylcyclohexyl)-1,2-thiazole-3,5-diamine.

Molecular Properties

Compound Name5-N-(3,5-dimethylcyclohexyl)-1,2-thiazole-3,5-diamine
PubChem CID103359753
Molecular FormulaC11H19N3S
Molecular Weight225.36 g/mol
Exact Mass225.13
IUPAC Name5-N-(3,5-dimethylcyclohexyl)-1,2-thiazole-3,5-diamine
SMILESCC1CC(C)CC(Nc2cc(N)ns2)C1
InChIInChI=1S/C11H19N3S/c1-7-3-8(2)5-9(4-7)13-11-6-10(12)14-15-11/h6-9,13H,3-5H2,1-2H3,(H2,12,14)
InChIKeyDLSANHXFTWTURM-UHFFFAOYSA-N
XLogP2.96
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.36
LogP ≤ 52.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 5-N-(3,5-dimethylcyclohexyl)-1,2-thiazole-3,5-diamine 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 5-N-(3,5-dimethylcyclohexyl)-1,2-thiazole-3,5-diamine?
The IUPAC name of 5-N-(3,5-dimethylcyclohexyl)-1,2-thiazole-3,5-diamine (CID 103359753) is 5-N-(3,5-dimethylcyclohexyl)-1,2-thiazole-3,5-diamine.
What is the SMILES notation for 5-N-(3,5-dimethylcyclohexyl)-1,2-thiazole-3,5-diamine?
The canonical SMILES for 5-N-(3,5-dimethylcyclohexyl)-1,2-thiazole-3,5-diamine is CC1CC(C)CC(Nc2cc(N)ns2)C1.
What is the InChIKey of 5-N-(3,5-dimethylcyclohexyl)-1,2-thiazole-3,5-diamine?
The InChIKey is DLSANHXFTWTURM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3S/c1-7-3-8(2)5-9(4-7)13-11-6-10(12)14-15-11/h6-9,13H,3-5H2,1-2H3,(H2,12,14).
What are the key properties of 5-N-(3,5-dimethylcyclohexyl)-1,2-thiazole-3,5-diamine?
5-N-(3,5-dimethylcyclohexyl)-1,2-thiazole-3,5-diamine has a molecular weight of 225.36 g/mol, XLogP of 2.96, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-N-(3,5-dimethylcyclohexyl)-1,2-thiazole-3,5-diamine is sourced from PubChem (CID 103359753), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).