6-(trifluoromethyl)-N-(3,3,5-trimethylcyclohexyl)pyridin-3-amine

C15H21F3N2 — CID 82811681

IUPAC6-(trifluoromethyl)-N-(3,3,5-trimethylcyclohexyl)pyridin-3-amine
SMILESCC1CC(Nc2ccc(C(F)(F)F)nc2)CC(C)(C)C1
InChIInChI=1S/C15H21F3N2/c1-10-6-12(8-14(2,3)7-10)20-11-4-5-13(19-9-11)15(16,17)18/h4-5,9-10,12,20H,6-8H2,1-3H3
InChIKeyKUGJKWQHVVVTGU-UHFFFAOYSA-N
MW286.34 g/mol
LogP4.73
Rot. Bonds2

About 6-(trifluoromethyl)-N-(3,3,5-trimethylcyclohexyl)pyridin-3-amine

6-(trifluoromethyl)-N-(3,3,5-trimethylcyclohexyl)pyridin-3-amine (PubChem CID 82811681) has the molecular formula C15H21F3N2 and a molecular weight of 286.34 g/mol. Its IUPAC name is 6-(trifluoromethyl)-N-(3,3,5-trimethylcyclohexyl)pyridin-3-amine.

Molecular Properties

Compound Name6-(trifluoromethyl)-N-(3,3,5-trimethylcyclohexyl)pyridin-3-amine
PubChem CID82811681
Molecular FormulaC15H21F3N2
Molecular Weight286.34 g/mol
Exact Mass286.17
IUPAC Name6-(trifluoromethyl)-N-(3,3,5-trimethylcyclohexyl)pyridin-3-amine
SMILESCC1CC(Nc2ccc(C(F)(F)F)nc2)CC(C)(C)C1
InChIInChI=1S/C15H21F3N2/c1-10-6-12(8-14(2,3)7-10)20-11-4-5-13(19-9-11)15(16,17)18/h4-5,9-10,12,20H,6-8H2,1-3H3
InChIKeyKUGJKWQHVVVTGU-UHFFFAOYSA-N
XLogP4.73
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.34
LogP ≤ 54.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6-(trifluoromethyl)-N-(3,3,5-trimethylcyclohexyl)pyridin-3-amine?
The IUPAC name of 6-(trifluoromethyl)-N-(3,3,5-trimethylcyclohexyl)pyridin-3-amine (CID 82811681) is 6-(trifluoromethyl)-N-(3,3,5-trimethylcyclohexyl)pyridin-3-amine.
What is the SMILES notation for 6-(trifluoromethyl)-N-(3,3,5-trimethylcyclohexyl)pyridin-3-amine?
The canonical SMILES for 6-(trifluoromethyl)-N-(3,3,5-trimethylcyclohexyl)pyridin-3-amine is CC1CC(Nc2ccc(C(F)(F)F)nc2)CC(C)(C)C1.
What is the InChIKey of 6-(trifluoromethyl)-N-(3,3,5-trimethylcyclohexyl)pyridin-3-amine?
The InChIKey is KUGJKWQHVVVTGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21F3N2/c1-10-6-12(8-14(2,3)7-10)20-11-4-5-13(19-9-11)15(16,17)18/h4-5,9-10,12,20H,6-8H2,1-3H3.
What are the key properties of 6-(trifluoromethyl)-N-(3,3,5-trimethylcyclohexyl)pyridin-3-amine?
6-(trifluoromethyl)-N-(3,3,5-trimethylcyclohexyl)pyridin-3-amine has a molecular weight of 286.34 g/mol, XLogP of 4.73, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(trifluoromethyl)-N-(3,3,5-trimethylcyclohexyl)pyridin-3-amine is sourced from PubChem (CID 82811681), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).