2-ethyl-6-(trifluoromethyl)-1,2,3,4-tetrahydro-1,5-naphthyridin-4-amine;hydrochloride

C11H15ClF3N3 — CID 86724701

IUPAC2-ethyl-6-(trifluoromethyl)-1,2,3,4-tetrahydro-1,5-naphthyridin-4-amine;hydrochloride
SMILESCCC1CC(N)c2nc(C(F)(F)F)ccc2N1.Cl
InChIInChI=1S/C11H14F3N3.ClH/c1-2-6-5-7(15)10-8(16-6)3-4-9(17-10)11(12,13)14;/h3-4,6-7,16H,2,5,15H2,1H3;1H
InChIKeyOBWQFUJPCJILER-UHFFFAOYSA-N
MW281.71 g/mol
LogP3.12
Rot. Bonds1

About 2-ethyl-6-(trifluoromethyl)-1,2,3,4-tetrahydro-1,5-naphthyridin-4-amine;hydrochloride

2-ethyl-6-(trifluoromethyl)-1,2,3,4-tetrahydro-1,5-naphthyridin-4-amine;hydrochloride (PubChem CID 86724701) has the molecular formula C11H15ClF3N3 and a molecular weight of 281.71 g/mol. Its IUPAC name is 2-ethyl-6-(trifluoromethyl)-1,2,3,4-tetrahydro-1,5-naphthyridin-4-amine;hydrochloride.

Molecular Properties

Compound Name2-ethyl-6-(trifluoromethyl)-1,2,3,4-tetrahydro-1,5-naphthyridin-4-amine;hydrochloride
PubChem CID86724701
Molecular FormulaC11H15ClF3N3
Molecular Weight281.71 g/mol
Exact Mass281.09
IUPAC Name2-ethyl-6-(trifluoromethyl)-1,2,3,4-tetrahydro-1,5-naphthyridin-4-amine;hydrochloride
SMILESCCC1CC(N)c2nc(C(F)(F)F)ccc2N1.Cl
InChIInChI=1S/C11H14F3N3.ClH/c1-2-6-5-7(15)10-8(16-6)3-4-9(17-10)11(12,13)14;/h3-4,6-7,16H,2,5,15H2,1H3;1H
InChIKeyOBWQFUJPCJILER-UHFFFAOYSA-N
XLogP3.12
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.71
LogP ≤ 53.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-ethyl-6-(trifluoromethyl)-1,2,3,4-tetrahydro-1,5-naphthyridin-4-amine;hydrochloride with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-6-(trifluoromethyl)-1,2,3,4-tetrahydro-1,5-naphthyridin-4-amine;hydrochloride?
The IUPAC name of 2-ethyl-6-(trifluoromethyl)-1,2,3,4-tetrahydro-1,5-naphthyridin-4-amine;hydrochloride (CID 86724701) is 2-ethyl-6-(trifluoromethyl)-1,2,3,4-tetrahydro-1,5-naphthyridin-4-amine;hydrochloride.
What is the SMILES notation for 2-ethyl-6-(trifluoromethyl)-1,2,3,4-tetrahydro-1,5-naphthyridin-4-amine;hydrochloride?
The canonical SMILES for 2-ethyl-6-(trifluoromethyl)-1,2,3,4-tetrahydro-1,5-naphthyridin-4-amine;hydrochloride is CCC1CC(N)c2nc(C(F)(F)F)ccc2N1.Cl.
What is the InChIKey of 2-ethyl-6-(trifluoromethyl)-1,2,3,4-tetrahydro-1,5-naphthyridin-4-amine;hydrochloride?
The InChIKey is OBWQFUJPCJILER-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14F3N3.ClH/c1-2-6-5-7(15)10-8(16-6)3-4-9(17-10)11(12,13)14;/h3-4,6-7,16H,2,5,15H2,1H3;1H.
What are the key properties of 2-ethyl-6-(trifluoromethyl)-1,2,3,4-tetrahydro-1,5-naphthyridin-4-amine;hydrochloride?
2-ethyl-6-(trifluoromethyl)-1,2,3,4-tetrahydro-1,5-naphthyridin-4-amine;hydrochloride has a molecular weight of 281.71 g/mol, XLogP of 3.12, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-6-(trifluoromethyl)-1,2,3,4-tetrahydro-1,5-naphthyridin-4-amine;hydrochloride is sourced from PubChem (CID 86724701), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).