4-(2,2-dimethyloxan-4-yl)-1,3-thiazol-2-amine

C10H16N2OS — CID 648091

IUPAC4-(2,2-dimethyloxan-4-yl)-1,3-thiazol-2-amine
SMILESCC1(C)CC(c2csc(N)n2)CCO1
InChIInChI=1S/C10H16N2OS/c1-10(2)5-7(3-4-13-10)8-6-14-9(11)12-8/h6-7H,3-5H2,1-2H3,(H2,11,12)
InChIKeyOMPHQJYCFNDVJT-UHFFFAOYSA-N
MW212.32 g/mol
LogP2.40
Rot. Bonds1

About 4-(2,2-dimethyloxan-4-yl)-1,3-thiazol-2-amine

4-(2,2-dimethyloxan-4-yl)-1,3-thiazol-2-amine (PubChem CID 648091) has the molecular formula C10H16N2OS and a molecular weight of 212.32 g/mol. Its IUPAC name is 4-(2,2-dimethyloxan-4-yl)-1,3-thiazol-2-amine.

Molecular Properties

Compound Name4-(2,2-dimethyloxan-4-yl)-1,3-thiazol-2-amine
PubChem CID648091
Molecular FormulaC10H16N2OS
Molecular Weight212.32 g/mol
Exact Mass212.10
IUPAC Name4-(2,2-dimethyloxan-4-yl)-1,3-thiazol-2-amine
SMILESCC1(C)CC(c2csc(N)n2)CCO1
InChIInChI=1S/C10H16N2OS/c1-10(2)5-7(3-4-13-10)8-6-14-9(11)12-8/h6-7H,3-5H2,1-2H3,(H2,11,12)
InChIKeyOMPHQJYCFNDVJT-UHFFFAOYSA-N
XLogP2.40
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.32
LogP ≤ 52.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 4-(2,2-dimethyloxan-4-yl)-1,3-thiazol-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

Frequently Asked Questions

What is the IUPAC name of 4-(2,2-dimethyloxan-4-yl)-1,3-thiazol-2-amine?
The IUPAC name of 4-(2,2-dimethyloxan-4-yl)-1,3-thiazol-2-amine (CID 648091) is 4-(2,2-dimethyloxan-4-yl)-1,3-thiazol-2-amine.
What is the SMILES notation for 4-(2,2-dimethyloxan-4-yl)-1,3-thiazol-2-amine?
The canonical SMILES for 4-(2,2-dimethyloxan-4-yl)-1,3-thiazol-2-amine is CC1(C)CC(c2csc(N)n2)CCO1.
What is the InChIKey of 4-(2,2-dimethyloxan-4-yl)-1,3-thiazol-2-amine?
The InChIKey is OMPHQJYCFNDVJT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2OS/c1-10(2)5-7(3-4-13-10)8-6-14-9(11)12-8/h6-7H,3-5H2,1-2H3,(H2,11,12).
What are the key properties of 4-(2,2-dimethyloxan-4-yl)-1,3-thiazol-2-amine?
4-(2,2-dimethyloxan-4-yl)-1,3-thiazol-2-amine has a molecular weight of 212.32 g/mol, XLogP of 2.40, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,2-dimethyloxan-4-yl)-1,3-thiazol-2-amine is sourced from PubChem (CID 648091), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).