6-ethyl-6-methyl-4-(trifluoromethyl)-4,5-dihydro-3H-pyridin-2-amine

C9H15F3N2 — CID 146246782

IUPAC6-ethyl-6-methyl-4-(trifluoromethyl)-4,5-dihydro-3H-pyridin-2-amine
SMILESCCC1(C)CC(C(F)(F)F)CC(N)=N1
InChIInChI=1S/C9H15F3N2/c1-3-8(2)5-6(9(10,11)12)4-7(13)14-8/h6H,3-5H2,1-2H3,(H2,13,14)
InChIKeySVTKIQAHYLKEPL-UHFFFAOYSA-N
MW208.23 g/mol
LogP2.48
Rot. Bonds1

About 6-ethyl-6-methyl-4-(trifluoromethyl)-4,5-dihydro-3H-pyridin-2-amine

6-ethyl-6-methyl-4-(trifluoromethyl)-4,5-dihydro-3H-pyridin-2-amine (PubChem CID 146246782) has the molecular formula C9H15F3N2 and a molecular weight of 208.23 g/mol. Its IUPAC name is 6-ethyl-6-methyl-4-(trifluoromethyl)-4,5-dihydro-3H-pyridin-2-amine.

Molecular Properties

Compound Name6-ethyl-6-methyl-4-(trifluoromethyl)-4,5-dihydro-3H-pyridin-2-amine
PubChem CID146246782
Molecular FormulaC9H15F3N2
Molecular Weight208.23 g/mol
Exact Mass208.12
IUPAC Name6-ethyl-6-methyl-4-(trifluoromethyl)-4,5-dihydro-3H-pyridin-2-amine
SMILESCCC1(C)CC(C(F)(F)F)CC(N)=N1
InChIInChI=1S/C9H15F3N2/c1-3-8(2)5-6(9(10,11)12)4-7(13)14-8/h6H,3-5H2,1-2H3,(H2,13,14)
InChIKeySVTKIQAHYLKEPL-UHFFFAOYSA-N
XLogP2.48
TPSA38.38 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.23
LogP ≤ 52.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6-ethyl-6-methyl-4-(trifluoromethyl)-4,5-dihydro-3H-pyridin-2-amine?
The IUPAC name of 6-ethyl-6-methyl-4-(trifluoromethyl)-4,5-dihydro-3H-pyridin-2-amine (CID 146246782) is 6-ethyl-6-methyl-4-(trifluoromethyl)-4,5-dihydro-3H-pyridin-2-amine.
What is the SMILES notation for 6-ethyl-6-methyl-4-(trifluoromethyl)-4,5-dihydro-3H-pyridin-2-amine?
The canonical SMILES for 6-ethyl-6-methyl-4-(trifluoromethyl)-4,5-dihydro-3H-pyridin-2-amine is CCC1(C)CC(C(F)(F)F)CC(N)=N1.
What is the InChIKey of 6-ethyl-6-methyl-4-(trifluoromethyl)-4,5-dihydro-3H-pyridin-2-amine?
The InChIKey is SVTKIQAHYLKEPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15F3N2/c1-3-8(2)5-6(9(10,11)12)4-7(13)14-8/h6H,3-5H2,1-2H3,(H2,13,14).
What are the key properties of 6-ethyl-6-methyl-4-(trifluoromethyl)-4,5-dihydro-3H-pyridin-2-amine?
6-ethyl-6-methyl-4-(trifluoromethyl)-4,5-dihydro-3H-pyridin-2-amine has a molecular weight of 208.23 g/mol, XLogP of 2.48, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethyl-6-methyl-4-(trifluoromethyl)-4,5-dihydro-3H-pyridin-2-amine is sourced from PubChem (CID 146246782), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).