3-(1,3-thiazol-2-yloxy)cyclohexan-1-amine

C9H14N2OS — CID 79464803

IUPAC3-(1,3-thiazol-2-yloxy)cyclohexan-1-amine
SMILESNC1CCCC(Oc2nccs2)C1
InChIInChI=1S/C9H14N2OS/c10-7-2-1-3-8(6-7)12-9-11-4-5-13-9/h4-5,7-8H,1-3,6,10H2
InChIKeyJHHVLGKMMUEGKU-UHFFFAOYSA-N
MW198.29 g/mol
LogP1.79
Rot. Bonds2

About 3-(1,3-thiazol-2-yloxy)cyclohexan-1-amine

3-(1,3-thiazol-2-yloxy)cyclohexan-1-amine (PubChem CID 79464803) has the molecular formula C9H14N2OS and a molecular weight of 198.29 g/mol. Its IUPAC name is 3-(1,3-thiazol-2-yloxy)cyclohexan-1-amine.

Molecular Properties

Compound Name3-(1,3-thiazol-2-yloxy)cyclohexan-1-amine
PubChem CID79464803
Molecular FormulaC9H14N2OS
Molecular Weight198.29 g/mol
Exact Mass198.08
IUPAC Name3-(1,3-thiazol-2-yloxy)cyclohexan-1-amine
SMILESNC1CCCC(Oc2nccs2)C1
InChIInChI=1S/C9H14N2OS/c10-7-2-1-3-8(6-7)12-9-11-4-5-13-9/h4-5,7-8H,1-3,6,10H2
InChIKeyJHHVLGKMMUEGKU-UHFFFAOYSA-N
XLogP1.79
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.29
LogP ≤ 51.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 3-(1,3-thiazol-2-yloxy)cyclohexan-1-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 3-(1,3-thiazol-2-yloxy)cyclohexan-1-amine?
The IUPAC name of 3-(1,3-thiazol-2-yloxy)cyclohexan-1-amine (CID 79464803) is 3-(1,3-thiazol-2-yloxy)cyclohexan-1-amine.
What is the SMILES notation for 3-(1,3-thiazol-2-yloxy)cyclohexan-1-amine?
The canonical SMILES for 3-(1,3-thiazol-2-yloxy)cyclohexan-1-amine is NC1CCCC(Oc2nccs2)C1.
What is the InChIKey of 3-(1,3-thiazol-2-yloxy)cyclohexan-1-amine?
The InChIKey is JHHVLGKMMUEGKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N2OS/c10-7-2-1-3-8(6-7)12-9-11-4-5-13-9/h4-5,7-8H,1-3,6,10H2.
What are the key properties of 3-(1,3-thiazol-2-yloxy)cyclohexan-1-amine?
3-(1,3-thiazol-2-yloxy)cyclohexan-1-amine has a molecular weight of 198.29 g/mol, XLogP of 1.79, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1,3-thiazol-2-yloxy)cyclohexan-1-amine is sourced from PubChem (CID 79464803), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).