N-methyl-1-(1,3-thiazol-2-yl)-4-(trifluoromethyl)cyclohexan-1-amine

C11H15F3N2S — CID 64754918

IUPACN-methyl-1-(1,3-thiazol-2-yl)-4-(trifluoromethyl)cyclohexan-1-amine
SMILESCNC1(c2nccs2)CCC(C(F)(F)F)CC1
InChIInChI=1S/C11H15F3N2S/c1-15-10(9-16-6-7-17-9)4-2-8(3-5-10)11(12,13)14/h6-8,15H,2-5H2,1H3
InChIKeyDMOSDNNUMPTLRB-UHFFFAOYSA-N
MW264.32 g/mol
LogP3.31
Rot. Bonds2

About N-methyl-1-(1,3-thiazol-2-yl)-4-(trifluoromethyl)cyclohexan-1-amine

N-methyl-1-(1,3-thiazol-2-yl)-4-(trifluoromethyl)cyclohexan-1-amine (PubChem CID 64754918) has the molecular formula C11H15F3N2S and a molecular weight of 264.32 g/mol. Its IUPAC name is N-methyl-1-(1,3-thiazol-2-yl)-4-(trifluoromethyl)cyclohexan-1-amine.

Molecular Properties

Compound NameN-methyl-1-(1,3-thiazol-2-yl)-4-(trifluoromethyl)cyclohexan-1-amine
PubChem CID64754918
Molecular FormulaC11H15F3N2S
Molecular Weight264.32 g/mol
Exact Mass264.09
IUPAC NameN-methyl-1-(1,3-thiazol-2-yl)-4-(trifluoromethyl)cyclohexan-1-amine
SMILESCNC1(c2nccs2)CCC(C(F)(F)F)CC1
InChIInChI=1S/C11H15F3N2S/c1-15-10(9-16-6-7-17-9)4-2-8(3-5-10)11(12,13)14/h6-8,15H,2-5H2,1H3
InChIKeyDMOSDNNUMPTLRB-UHFFFAOYSA-N
XLogP3.31
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.32
LogP ≤ 53.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-methyl-1-(1,3-thiazol-2-yl)-4-(trifluoromethyl)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 N-methyl-1-(1,3-thiazol-2-yl)-4-(trifluoromethyl)cyclohexan-1-amine?
The IUPAC name of N-methyl-1-(1,3-thiazol-2-yl)-4-(trifluoromethyl)cyclohexan-1-amine (CID 64754918) is N-methyl-1-(1,3-thiazol-2-yl)-4-(trifluoromethyl)cyclohexan-1-amine.
What is the SMILES notation for N-methyl-1-(1,3-thiazol-2-yl)-4-(trifluoromethyl)cyclohexan-1-amine?
The canonical SMILES for N-methyl-1-(1,3-thiazol-2-yl)-4-(trifluoromethyl)cyclohexan-1-amine is CNC1(c2nccs2)CCC(C(F)(F)F)CC1.
What is the InChIKey of N-methyl-1-(1,3-thiazol-2-yl)-4-(trifluoromethyl)cyclohexan-1-amine?
The InChIKey is DMOSDNNUMPTLRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15F3N2S/c1-15-10(9-16-6-7-17-9)4-2-8(3-5-10)11(12,13)14/h6-8,15H,2-5H2,1H3.
What are the key properties of N-methyl-1-(1,3-thiazol-2-yl)-4-(trifluoromethyl)cyclohexan-1-amine?
N-methyl-1-(1,3-thiazol-2-yl)-4-(trifluoromethyl)cyclohexan-1-amine has a molecular weight of 264.32 g/mol, XLogP of 3.31, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(1,3-thiazol-2-yl)-4-(trifluoromethyl)cyclohexan-1-amine is sourced from PubChem (CID 64754918), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).