4-chloro-N-(4-ethylcyclohexyl)-1,3-thiazol-2-amine

C11H17ClN2S — CID 83151941

IUPAC4-chloro-N-(4-ethylcyclohexyl)-1,3-thiazol-2-amine
SMILESCCC1CCC(Nc2nc(Cl)cs2)CC1
InChIInChI=1S/C11H17ClN2S/c1-2-8-3-5-9(6-4-8)13-11-14-10(12)7-15-11/h7-9H,2-6H2,1H3,(H,13,14)
InChIKeyGARRGYAPRSPLCX-UHFFFAOYSA-N
MW244.79 g/mol
LogP4.18
Rot. Bonds3

About 4-chloro-N-(4-ethylcyclohexyl)-1,3-thiazol-2-amine

4-chloro-N-(4-ethylcyclohexyl)-1,3-thiazol-2-amine (PubChem CID 83151941) has the molecular formula C11H17ClN2S and a molecular weight of 244.79 g/mol. Its IUPAC name is 4-chloro-N-(4-ethylcyclohexyl)-1,3-thiazol-2-amine.

Molecular Properties

Compound Name4-chloro-N-(4-ethylcyclohexyl)-1,3-thiazol-2-amine
PubChem CID83151941
Molecular FormulaC11H17ClN2S
Molecular Weight244.79 g/mol
Exact Mass244.08
IUPAC Name4-chloro-N-(4-ethylcyclohexyl)-1,3-thiazol-2-amine
SMILESCCC1CCC(Nc2nc(Cl)cs2)CC1
InChIInChI=1S/C11H17ClN2S/c1-2-8-3-5-9(6-4-8)13-11-14-10(12)7-15-11/h7-9H,2-6H2,1H3,(H,13,14)
InChIKeyGARRGYAPRSPLCX-UHFFFAOYSA-N
XLogP4.18
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.79
LogP ≤ 54.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 4-chloro-N-(4-ethylcyclohexyl)-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-chloro-N-(4-ethylcyclohexyl)-1,3-thiazol-2-amine?
The IUPAC name of 4-chloro-N-(4-ethylcyclohexyl)-1,3-thiazol-2-amine (CID 83151941) is 4-chloro-N-(4-ethylcyclohexyl)-1,3-thiazol-2-amine.
What is the SMILES notation for 4-chloro-N-(4-ethylcyclohexyl)-1,3-thiazol-2-amine?
The canonical SMILES for 4-chloro-N-(4-ethylcyclohexyl)-1,3-thiazol-2-amine is CCC1CCC(Nc2nc(Cl)cs2)CC1.
What is the InChIKey of 4-chloro-N-(4-ethylcyclohexyl)-1,3-thiazol-2-amine?
The InChIKey is GARRGYAPRSPLCX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17ClN2S/c1-2-8-3-5-9(6-4-8)13-11-14-10(12)7-15-11/h7-9H,2-6H2,1H3,(H,13,14).
What are the key properties of 4-chloro-N-(4-ethylcyclohexyl)-1,3-thiazol-2-amine?
4-chloro-N-(4-ethylcyclohexyl)-1,3-thiazol-2-amine has a molecular weight of 244.79 g/mol, XLogP of 4.18, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-N-(4-ethylcyclohexyl)-1,3-thiazol-2-amine is sourced from PubChem (CID 83151941), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).