N-[3-(trifluoromethyl)cyclohexyl]-1,3-thiazol-2-amine

C10H13F3N2S — CID 112724238

IUPACN-[3-(trifluoromethyl)cyclohexyl]-1,3-thiazol-2-amine
SMILESFC(F)(F)C1CCCC(Nc2nccs2)C1
InChIInChI=1S/C10H13F3N2S/c11-10(12,13)7-2-1-3-8(6-7)15-9-14-4-5-16-9/h4-5,7-8H,1-3,6H2,(H,14,15)
InChIKeyAOSKMFICWXADME-UHFFFAOYSA-N
MW250.29 g/mol
LogP3.68
Rot. Bonds2

About N-[3-(trifluoromethyl)cyclohexyl]-1,3-thiazol-2-amine

N-[3-(trifluoromethyl)cyclohexyl]-1,3-thiazol-2-amine (PubChem CID 112724238) has the molecular formula C10H13F3N2S and a molecular weight of 250.29 g/mol. Its IUPAC name is N-[3-(trifluoromethyl)cyclohexyl]-1,3-thiazol-2-amine.

Molecular Properties

Compound NameN-[3-(trifluoromethyl)cyclohexyl]-1,3-thiazol-2-amine
PubChem CID112724238
Molecular FormulaC10H13F3N2S
Molecular Weight250.29 g/mol
Exact Mass250.08
IUPAC NameN-[3-(trifluoromethyl)cyclohexyl]-1,3-thiazol-2-amine
SMILESFC(F)(F)C1CCCC(Nc2nccs2)C1
InChIInChI=1S/C10H13F3N2S/c11-10(12,13)7-2-1-3-8(6-7)15-9-14-4-5-16-9/h4-5,7-8H,1-3,6H2,(H,14,15)
InChIKeyAOSKMFICWXADME-UHFFFAOYSA-N
XLogP3.68
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.29
LogP ≤ 53.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[3-(trifluoromethyl)cyclohexyl]-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 N-[3-(trifluoromethyl)cyclohexyl]-1,3-thiazol-2-amine?
The IUPAC name of N-[3-(trifluoromethyl)cyclohexyl]-1,3-thiazol-2-amine (CID 112724238) is N-[3-(trifluoromethyl)cyclohexyl]-1,3-thiazol-2-amine.
What is the SMILES notation for N-[3-(trifluoromethyl)cyclohexyl]-1,3-thiazol-2-amine?
The canonical SMILES for N-[3-(trifluoromethyl)cyclohexyl]-1,3-thiazol-2-amine is FC(F)(F)C1CCCC(Nc2nccs2)C1.
What is the InChIKey of N-[3-(trifluoromethyl)cyclohexyl]-1,3-thiazol-2-amine?
The InChIKey is AOSKMFICWXADME-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13F3N2S/c11-10(12,13)7-2-1-3-8(6-7)15-9-14-4-5-16-9/h4-5,7-8H,1-3,6H2,(H,14,15).
What are the key properties of N-[3-(trifluoromethyl)cyclohexyl]-1,3-thiazol-2-amine?
N-[3-(trifluoromethyl)cyclohexyl]-1,3-thiazol-2-amine has a molecular weight of 250.29 g/mol, XLogP of 3.68, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(trifluoromethyl)cyclohexyl]-1,3-thiazol-2-amine is sourced from PubChem (CID 112724238), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).