N-cyclohexyl-2-(trifluoromethyl)pyridin-4-amine

C12H15F3N2 — CID 3782047

IUPACN-cyclohexyl-2-(trifluoromethyl)pyridin-4-amine
SMILESFC(F)(F)c1cc(NC2CCCCC2)ccn1
InChIInChI=1S/C12H15F3N2/c13-12(14,15)11-8-10(6-7-16-11)17-9-4-2-1-3-5-9/h6-9H,1-5H2,(H,16,17)
InChIKeyXIQYAIZNKGJCSK-UHFFFAOYSA-N
MW244.26 g/mol
LogP3.85
Rot. Bonds2

About N-cyclohexyl-2-(trifluoromethyl)pyridin-4-amine

N-cyclohexyl-2-(trifluoromethyl)pyridin-4-amine (PubChem CID 3782047) has the molecular formula C12H15F3N2 and a molecular weight of 244.26 g/mol. Its IUPAC name is N-cyclohexyl-2-(trifluoromethyl)pyridin-4-amine.

Molecular Properties

Compound NameN-cyclohexyl-2-(trifluoromethyl)pyridin-4-amine
PubChem CID3782047
Molecular FormulaC12H15F3N2
Molecular Weight244.26 g/mol
Exact Mass244.12
IUPAC NameN-cyclohexyl-2-(trifluoromethyl)pyridin-4-amine
SMILESFC(F)(F)c1cc(NC2CCCCC2)ccn1
InChIInChI=1S/C12H15F3N2/c13-12(14,15)11-8-10(6-7-16-11)17-9-4-2-1-3-5-9/h6-9H,1-5H2,(H,16,17)
InChIKeyXIQYAIZNKGJCSK-UHFFFAOYSA-N
XLogP3.85
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.26
LogP ≤ 53.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-2-(trifluoromethyl)pyridin-4-amine?
The IUPAC name of N-cyclohexyl-2-(trifluoromethyl)pyridin-4-amine (CID 3782047) is N-cyclohexyl-2-(trifluoromethyl)pyridin-4-amine.
What is the SMILES notation for N-cyclohexyl-2-(trifluoromethyl)pyridin-4-amine?
The canonical SMILES for N-cyclohexyl-2-(trifluoromethyl)pyridin-4-amine is FC(F)(F)c1cc(NC2CCCCC2)ccn1.
What is the InChIKey of N-cyclohexyl-2-(trifluoromethyl)pyridin-4-amine?
The InChIKey is XIQYAIZNKGJCSK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15F3N2/c13-12(14,15)11-8-10(6-7-16-11)17-9-4-2-1-3-5-9/h6-9H,1-5H2,(H,16,17).
What are the key properties of N-cyclohexyl-2-(trifluoromethyl)pyridin-4-amine?
N-cyclohexyl-2-(trifluoromethyl)pyridin-4-amine has a molecular weight of 244.26 g/mol, XLogP of 3.85, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-2-(trifluoromethyl)pyridin-4-amine is sourced from PubChem (CID 3782047), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).