cyclohexyl-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methanamine

C11H15F3N2S — CID 106782992

IUPACcyclohexyl-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methanamine
SMILESNC(c1cnc(C(F)(F)F)s1)C1CCCCC1
InChIInChI=1S/C11H15F3N2S/c12-11(13,14)10-16-6-8(17-10)9(15)7-4-2-1-3-5-7/h6-7,9H,1-5,15H2
InChIKeyQIZGJYMMNJYHGX-UHFFFAOYSA-N
MW264.32 g/mol
LogP3.74
Rot. Bonds2

About cyclohexyl-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methanamine

cyclohexyl-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methanamine (PubChem CID 106782992) has the molecular formula C11H15F3N2S and a molecular weight of 264.32 g/mol. Its IUPAC name is cyclohexyl-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methanamine.

Molecular Properties

Compound Namecyclohexyl-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methanamine
PubChem CID106782992
Molecular FormulaC11H15F3N2S
Molecular Weight264.32 g/mol
Exact Mass264.09
IUPAC Namecyclohexyl-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methanamine
SMILESNC(c1cnc(C(F)(F)F)s1)C1CCCCC1
InChIInChI=1S/C11H15F3N2S/c12-11(13,14)10-16-6-8(17-10)9(15)7-4-2-1-3-5-7/h6-7,9H,1-5,15H2
InChIKeyQIZGJYMMNJYHGX-UHFFFAOYSA-N
XLogP3.74
TPSA38.91 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 ≤ 53.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-(7-Azabicyclo[2.2.1]heptan-2-yl)-2-(trifluoromethyl)-1,3-thiazole
CID 90902428
5-(7-Azabicyclo[2.2.1]heptan-2-yl)-2-fluoro-1,3-thiazole
CID 91381597
1-Methyl-2-(1,3-thiazol-5-yl)-2-(trifluoromethyl)piperidin-4-amine
CID 117721481
1-Methyl-2-[2-(trifluoromethyl)-1,3-thiazol-5-yl]piperidin-4-amine
CID 117721483
2-[2-(4,4-Difluorocyclohexyl)-1,3-thiazol-5-yl]-2-(4,4-difluoropiperidin-1-yl)ethanamine
CID 124183601
4-[2-(Difluoromethyl)-1,3-thiazol-5-yl]cyclohexan-1-amine
CID 146435255
5-Nonan-3-yl-2-(trifluoromethyl)-1,3-thiazole
CID 146558774
2-Propan-2-yl-5-[2-(trifluoromethyl)cyclohexyl]-1,3-thiazole
CID 157060119
5-[(4-Fluoropiperidin-4-yl)methyl]-2-methyl-1,3-thiazole
CID 163385852
5-Octan-2-yl-2-(trifluoromethyl)-1,3-thiazole
CID 167185113
5-[(1-Fluorocyclohexyl)methyl]-2-methyl-1,3-thiazole
CID 170152111
4,4-difluoro-N-[(5-propan-2-yl-1,3-thiazol-2-yl)methyl]cyclohexan-1-amine
CID 176397657

Frequently Asked Questions

What is the IUPAC name of cyclohexyl-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methanamine?
The IUPAC name of cyclohexyl-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methanamine (CID 106782992) is cyclohexyl-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methanamine.
What is the SMILES notation for cyclohexyl-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methanamine?
The canonical SMILES for cyclohexyl-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methanamine is NC(c1cnc(C(F)(F)F)s1)C1CCCCC1.
What is the InChIKey of cyclohexyl-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methanamine?
The InChIKey is QIZGJYMMNJYHGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15F3N2S/c12-11(13,14)10-16-6-8(17-10)9(15)7-4-2-1-3-5-7/h6-7,9H,1-5,15H2.
What are the key properties of cyclohexyl-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methanamine?
cyclohexyl-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methanamine has a molecular weight of 264.32 g/mol, XLogP of 3.74, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for cyclohexyl-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methanamine is sourced from PubChem (CID 106782992), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).