N-(4-propylcyclohexyl)-6-(trifluoromethyl)pyridin-2-amine

C15H21F3N2 — CID 63541353

IUPACN-(4-propylcyclohexyl)-6-(trifluoromethyl)pyridin-2-amine
SMILESCCCC1CCC(Nc2cccc(C(F)(F)F)n2)CC1
InChIInChI=1S/C15H21F3N2/c1-2-4-11-7-9-12(10-8-11)19-14-6-3-5-13(20-14)15(16,17)18/h3,5-6,11-12H,2,4,7-10H2,1H3,(H,19,20)
InChIKeyAIHQDURDPHPSJN-UHFFFAOYSA-N
MW286.34 g/mol
LogP4.87
Rot. Bonds4

About N-(4-propylcyclohexyl)-6-(trifluoromethyl)pyridin-2-amine

N-(4-propylcyclohexyl)-6-(trifluoromethyl)pyridin-2-amine (PubChem CID 63541353) has the molecular formula C15H21F3N2 and a molecular weight of 286.34 g/mol. Its IUPAC name is N-(4-propylcyclohexyl)-6-(trifluoromethyl)pyridin-2-amine.

Molecular Properties

Compound NameN-(4-propylcyclohexyl)-6-(trifluoromethyl)pyridin-2-amine
PubChem CID63541353
Molecular FormulaC15H21F3N2
Molecular Weight286.34 g/mol
Exact Mass286.17
IUPAC NameN-(4-propylcyclohexyl)-6-(trifluoromethyl)pyridin-2-amine
SMILESCCCC1CCC(Nc2cccc(C(F)(F)F)n2)CC1
InChIInChI=1S/C15H21F3N2/c1-2-4-11-7-9-12(10-8-11)19-14-6-3-5-13(20-14)15(16,17)18/h3,5-6,11-12H,2,4,7-10H2,1H3,(H,19,20)
InChIKeyAIHQDURDPHPSJN-UHFFFAOYSA-N
XLogP4.87
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.34
LogP ≤ 54.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(4-propylcyclohexyl)-6-(trifluoromethyl)pyridin-2-amine?
The IUPAC name of N-(4-propylcyclohexyl)-6-(trifluoromethyl)pyridin-2-amine (CID 63541353) is N-(4-propylcyclohexyl)-6-(trifluoromethyl)pyridin-2-amine.
What is the SMILES notation for N-(4-propylcyclohexyl)-6-(trifluoromethyl)pyridin-2-amine?
The canonical SMILES for N-(4-propylcyclohexyl)-6-(trifluoromethyl)pyridin-2-amine is CCCC1CCC(Nc2cccc(C(F)(F)F)n2)CC1.
What is the InChIKey of N-(4-propylcyclohexyl)-6-(trifluoromethyl)pyridin-2-amine?
The InChIKey is AIHQDURDPHPSJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21F3N2/c1-2-4-11-7-9-12(10-8-11)19-14-6-3-5-13(20-14)15(16,17)18/h3,5-6,11-12H,2,4,7-10H2,1H3,(H,19,20).
What are the key properties of N-(4-propylcyclohexyl)-6-(trifluoromethyl)pyridin-2-amine?
N-(4-propylcyclohexyl)-6-(trifluoromethyl)pyridin-2-amine has a molecular weight of 286.34 g/mol, XLogP of 4.87, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-propylcyclohexyl)-6-(trifluoromethyl)pyridin-2-amine is sourced from PubChem (CID 63541353), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).