N-(1-cyclohexylpropyl)-4-(trifluoromethyl)pyridin-2-amine

C15H21F3N2 — CID 66329261

IUPACN-(1-cyclohexylpropyl)-4-(trifluoromethyl)pyridin-2-amine
SMILESCCC(Nc1cc(C(F)(F)F)ccn1)C1CCCCC1
InChIInChI=1S/C15H21F3N2/c1-2-13(11-6-4-3-5-7-11)20-14-10-12(8-9-19-14)15(16,17)18/h8-11,13H,2-7H2,1H3,(H,19,20)
InChIKeyHZHYIEFQKDMHTK-UHFFFAOYSA-N
MW286.34 g/mol
LogP4.87
Rot. Bonds4

About N-(1-cyclohexylpropyl)-4-(trifluoromethyl)pyridin-2-amine

N-(1-cyclohexylpropyl)-4-(trifluoromethyl)pyridin-2-amine (PubChem CID 66329261) has the molecular formula C15H21F3N2 and a molecular weight of 286.34 g/mol. Its IUPAC name is N-(1-cyclohexylpropyl)-4-(trifluoromethyl)pyridin-2-amine.

Molecular Properties

Compound NameN-(1-cyclohexylpropyl)-4-(trifluoromethyl)pyridin-2-amine
PubChem CID66329261
Molecular FormulaC15H21F3N2
Molecular Weight286.34 g/mol
Exact Mass286.17
IUPAC NameN-(1-cyclohexylpropyl)-4-(trifluoromethyl)pyridin-2-amine
SMILESCCC(Nc1cc(C(F)(F)F)ccn1)C1CCCCC1
InChIInChI=1S/C15H21F3N2/c1-2-13(11-6-4-3-5-7-11)20-14-10-12(8-9-19-14)15(16,17)18/h8-11,13H,2-7H2,1H3,(H,19,20)
InChIKeyHZHYIEFQKDMHTK-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-(1-cyclohexylpropyl)-4-(trifluoromethyl)pyridin-2-amine?
The IUPAC name of N-(1-cyclohexylpropyl)-4-(trifluoromethyl)pyridin-2-amine (CID 66329261) is N-(1-cyclohexylpropyl)-4-(trifluoromethyl)pyridin-2-amine.
What is the SMILES notation for N-(1-cyclohexylpropyl)-4-(trifluoromethyl)pyridin-2-amine?
The canonical SMILES for N-(1-cyclohexylpropyl)-4-(trifluoromethyl)pyridin-2-amine is CCC(Nc1cc(C(F)(F)F)ccn1)C1CCCCC1.
What is the InChIKey of N-(1-cyclohexylpropyl)-4-(trifluoromethyl)pyridin-2-amine?
The InChIKey is HZHYIEFQKDMHTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21F3N2/c1-2-13(11-6-4-3-5-7-11)20-14-10-12(8-9-19-14)15(16,17)18/h8-11,13H,2-7H2,1H3,(H,19,20).
What are the key properties of N-(1-cyclohexylpropyl)-4-(trifluoromethyl)pyridin-2-amine?
N-(1-cyclohexylpropyl)-4-(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-(1-cyclohexylpropyl)-4-(trifluoromethyl)pyridin-2-amine is sourced from PubChem (CID 66329261), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).