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

C11H17ClN2S — CID 83151952

IUPAC4-chloro-N-(2,4-dimethylcyclohexyl)-1,3-thiazol-2-amine
SMILESCC1CCC(Nc2nc(Cl)cs2)C(C)C1
InChIInChI=1S/C11H17ClN2S/c1-7-3-4-9(8(2)5-7)13-11-14-10(12)6-15-11/h6-9H,3-5H2,1-2H3,(H,13,14)
InChIKeyYKXVPVVTSFFVGW-UHFFFAOYSA-N
MW244.79 g/mol
LogP4.03
Rot. Bonds2

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

4-chloro-N-(2,4-dimethylcyclohexyl)-1,3-thiazol-2-amine (PubChem CID 83151952) has the molecular formula C11H17ClN2S and a molecular weight of 244.79 g/mol. Its IUPAC name is 4-chloro-N-(2,4-dimethylcyclohexyl)-1,3-thiazol-2-amine.

Molecular Properties

Compound Name4-chloro-N-(2,4-dimethylcyclohexyl)-1,3-thiazol-2-amine
PubChem CID83151952
Molecular FormulaC11H17ClN2S
Molecular Weight244.79 g/mol
Exact Mass244.08
IUPAC Name4-chloro-N-(2,4-dimethylcyclohexyl)-1,3-thiazol-2-amine
SMILESCC1CCC(Nc2nc(Cl)cs2)C(C)C1
InChIInChI=1S/C11H17ClN2S/c1-7-3-4-9(8(2)5-7)13-11-14-10(12)6-15-11/h6-9H,3-5H2,1-2H3,(H,13,14)
InChIKeyYKXVPVVTSFFVGW-UHFFFAOYSA-N
XLogP4.03
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.79
LogP ≤ 54.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 4-chloro-N-(2,4-dimethylcyclohexyl)-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

Related Compounds

CID 59229918
CID 59229918
CID 28523564
CID 28523564
CID 43097307
CID 43097307
CID 47151315
CID 47151315
CID 47151324
CID 47151324
CID 47357637
CID 47357637
CID 63994523
CID 63994523
CID 63996714
CID 63996714
CID 64732895
CID 64732895
CID 79047349
CID 79047349
CID 79398777
CID 79398777
CID 79398895
CID 79398895

Frequently Asked Questions

What is the IUPAC name of 4-chloro-N-(2,4-dimethylcyclohexyl)-1,3-thiazol-2-amine?
The IUPAC name of 4-chloro-N-(2,4-dimethylcyclohexyl)-1,3-thiazol-2-amine (CID 83151952) is 4-chloro-N-(2,4-dimethylcyclohexyl)-1,3-thiazol-2-amine.
What is the SMILES notation for 4-chloro-N-(2,4-dimethylcyclohexyl)-1,3-thiazol-2-amine?
The canonical SMILES for 4-chloro-N-(2,4-dimethylcyclohexyl)-1,3-thiazol-2-amine is CC1CCC(Nc2nc(Cl)cs2)C(C)C1.
What is the InChIKey of 4-chloro-N-(2,4-dimethylcyclohexyl)-1,3-thiazol-2-amine?
The InChIKey is YKXVPVVTSFFVGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17ClN2S/c1-7-3-4-9(8(2)5-7)13-11-14-10(12)6-15-11/h6-9H,3-5H2,1-2H3,(H,13,14).
What are the key properties of 4-chloro-N-(2,4-dimethylcyclohexyl)-1,3-thiazol-2-amine?
4-chloro-N-(2,4-dimethylcyclohexyl)-1,3-thiazol-2-amine has a molecular weight of 244.79 g/mol, XLogP of 4.03, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-N-(2,4-dimethylcyclohexyl)-1,3-thiazol-2-amine is sourced from PubChem (CID 83151952), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).