N-(4-methylcyclohexyl)-3-(trifluoromethyl)-1,2,4-thiadiazol-5-amine

C10H14F3N3S — CID 107305205

IUPACN-(4-methylcyclohexyl)-3-(trifluoromethyl)-1,2,4-thiadiazol-5-amine
SMILESCC1CCC(Nc2nc(C(F)(F)F)ns2)CC1
InChIInChI=1S/C10H14F3N3S/c1-6-2-4-7(5-3-6)14-9-15-8(16-17-9)10(11,12)13/h6-7H,2-5H2,1H3,(H,14,15,16)
InChIKeyCAUDWFMXWRHBIX-UHFFFAOYSA-N
MW265.30 g/mol
LogP3.55
Rot. Bonds2

About N-(4-methylcyclohexyl)-3-(trifluoromethyl)-1,2,4-thiadiazol-5-amine

N-(4-methylcyclohexyl)-3-(trifluoromethyl)-1,2,4-thiadiazol-5-amine (PubChem CID 107305205) has the molecular formula C10H14F3N3S and a molecular weight of 265.30 g/mol. Its IUPAC name is N-(4-methylcyclohexyl)-3-(trifluoromethyl)-1,2,4-thiadiazol-5-amine.

Molecular Properties

Compound NameN-(4-methylcyclohexyl)-3-(trifluoromethyl)-1,2,4-thiadiazol-5-amine
PubChem CID107305205
Molecular FormulaC10H14F3N3S
Molecular Weight265.30 g/mol
Exact Mass265.09
IUPAC NameN-(4-methylcyclohexyl)-3-(trifluoromethyl)-1,2,4-thiadiazol-5-amine
SMILESCC1CCC(Nc2nc(C(F)(F)F)ns2)CC1
InChIInChI=1S/C10H14F3N3S/c1-6-2-4-7(5-3-6)14-9-15-8(16-17-9)10(11,12)13/h6-7H,2-5H2,1H3,(H,14,15,16)
InChIKeyCAUDWFMXWRHBIX-UHFFFAOYSA-N
XLogP3.55
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.30
LogP ≤ 53.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-(4-methylcyclohexyl)-3-(trifluoromethyl)-1,2,4-thiadiazol-5-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

3-cyclopropyl-N-[[4-(trifluoromethyl)cyclohexyl]methyl]-1,2,4-thiadiazol-5-amine
CID 91644106
N-[[4-[[3-(trifluoromethyl)-1,2,4-thiadiazol-5-yl]amino]cyclohexyl]methyl]ethanesulfonamide
CID 89986737
N-[4-[(tert-butylsulfanylamino)methyl]cyclohexyl]-3-(trifluoromethyl)-1,2,4-thiadiazol-5-amine
CID 89986770
2-methyl-N-[[4-[[3-(trifluoromethyl)-1,2,4-thiadiazol-5-yl]amino]cyclohexyl]methyl]propane-2-sulfonamide
CID 117784895
N-cyclohexyl-3-methyl-1,2,4-thiadiazol-5-amine
CID 12725102
N-[(3,3-dimethylpiperidin-2-yl)methyl]-3-(trifluoromethyl)-1,2,4-thiadiazol-5-amine
CID 105566429
N-[(1-propylcyclopropyl)methyl]-3-(trifluoromethyl)-1,2,4-thiadiazol-5-amine
CID 105701360
N-(2-ethylcyclopropyl)-3-(trifluoromethyl)-1,2,4-thiadiazol-5-amine
CID 105758902
N-(2-propylcyclopropyl)-3-(trifluoromethyl)-1,2,4-thiadiazol-5-amine
CID 105778734
N-[(1-methylsulfanylcyclohexyl)methyl]-3-(trifluoromethyl)-1,2,4-thiadiazol-5-amine
CID 105825420
N-[(1-ethylcyclopentyl)methyl]-3-(trifluoromethyl)-1,2,4-thiadiazol-5-amine
CID 105896438
N-(3-cyclopentylpropyl)-3-(trifluoromethyl)-1,2,4-thiadiazol-5-amine
CID 106012675

Frequently Asked Questions

What is the IUPAC name of N-(4-methylcyclohexyl)-3-(trifluoromethyl)-1,2,4-thiadiazol-5-amine?
The IUPAC name of N-(4-methylcyclohexyl)-3-(trifluoromethyl)-1,2,4-thiadiazol-5-amine (CID 107305205) is N-(4-methylcyclohexyl)-3-(trifluoromethyl)-1,2,4-thiadiazol-5-amine.
What is the SMILES notation for N-(4-methylcyclohexyl)-3-(trifluoromethyl)-1,2,4-thiadiazol-5-amine?
The canonical SMILES for N-(4-methylcyclohexyl)-3-(trifluoromethyl)-1,2,4-thiadiazol-5-amine is CC1CCC(Nc2nc(C(F)(F)F)ns2)CC1.
What is the InChIKey of N-(4-methylcyclohexyl)-3-(trifluoromethyl)-1,2,4-thiadiazol-5-amine?
The InChIKey is CAUDWFMXWRHBIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14F3N3S/c1-6-2-4-7(5-3-6)14-9-15-8(16-17-9)10(11,12)13/h6-7H,2-5H2,1H3,(H,14,15,16).
What are the key properties of N-(4-methylcyclohexyl)-3-(trifluoromethyl)-1,2,4-thiadiazol-5-amine?
N-(4-methylcyclohexyl)-3-(trifluoromethyl)-1,2,4-thiadiazol-5-amine has a molecular weight of 265.30 g/mol, XLogP of 3.55, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methylcyclohexyl)-3-(trifluoromethyl)-1,2,4-thiadiazol-5-amine is sourced from PubChem (CID 107305205), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).