[6-[[6-(trifluoromethyl)-2-pyridinyl]oxy]-1,2,3,4-tetrahydronaphthalen-1-yl]methanamine

C17H17F3N2O — CID 90242517

IUPAC[6-[[6-(trifluoromethyl)-2-pyridinyl]oxy]-1,2,3,4-tetrahydronaphthalen-1-yl]methanamine
SMILESNCC1CCCc2cc(Oc3cccc(C(F)(F)F)n3)ccc21
InChIInChI=1S/C17H17F3N2O/c18-17(19,20)15-5-2-6-16(22-15)23-13-7-8-14-11(9-13)3-1-4-12(14)10-21/h2,5-9,12H,1,3-4,10,21H2
InChIKeyOIZPJIRIQXOSSW-UHFFFAOYSA-N
MW322.33 g/mol
LogP4.27
Rot. Bonds3

About [6-[[6-(trifluoromethyl)-2-pyridinyl]oxy]-1,2,3,4-tetrahydronaphthalen-1-yl]methanamine

[6-[[6-(trifluoromethyl)-2-pyridinyl]oxy]-1,2,3,4-tetrahydronaphthalen-1-yl]methanamine (PubChem CID 90242517) has the molecular formula C17H17F3N2O and a molecular weight of 322.33 g/mol. Its IUPAC name is [6-[[6-(trifluoromethyl)-2-pyridinyl]oxy]-1,2,3,4-tetrahydronaphthalen-1-yl]methanamine.

Molecular Properties

Compound Name[6-[[6-(trifluoromethyl)-2-pyridinyl]oxy]-1,2,3,4-tetrahydronaphthalen-1-yl]methanamine
PubChem CID90242517
Molecular FormulaC17H17F3N2O
Molecular Weight322.33 g/mol
Exact Mass322.13
IUPAC Name[6-[[6-(trifluoromethyl)-2-pyridinyl]oxy]-1,2,3,4-tetrahydronaphthalen-1-yl]methanamine
SMILESNCC1CCCc2cc(Oc3cccc(C(F)(F)F)n3)ccc21
InChIInChI=1S/C17H17F3N2O/c18-17(19,20)15-5-2-6-16(22-15)23-13-7-8-14-11(9-13)3-1-4-12(14)10-21/h2,5-9,12H,1,3-4,10,21H2
InChIKeyOIZPJIRIQXOSSW-UHFFFAOYSA-N
XLogP4.27
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.33
LogP ≤ 54.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze [6-[[6-(trifluoromethyl)-2-pyridinyl]oxy]-1,2,3,4-tetrahydronaphthalen-1-yl]methanamine with MolForge

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

Launch Full Analysis

Related Compounds

2-Methyl-6-(3-(5,6,7,8-tetrahydronaphthalen-2-yloxy)prop-1-ynyl)pyridine
CID 11265885
(6-Methoxy-1,2,3,4-tetrahydro-naphthalen-2-ylmethyl)-[2-(pyridin-2-yloxy)-ethyl]-amine
CID 11758776
US11072585, Example 58
CID 122516817
US11072585, Example 57
CID 122516911
[2-(3-Phenylphenoxy)-6-(trifluoromethyl)pyridin-4-yl]methanamine
CID 122516950
[2-(3-Phenylphenoxy)-6-(trifluoromethyl)pyridin-4-yl]methanamine;2,2,2-trifluoroacetic acid
CID 132253085
{2-[5-Ethoxy-2-(trifluoromethyl)phenyl](4-quinolyl)}(3-piperidylpropyl)amine
CID 141703739
2-[(4-Phenylphenyl)methoxy]-6-(trifluoromethyl)pyridine
CID 172436070
2-(4-Methoxyphenyl)-4-phenyl-6-(trifluoromethyl)pyridine
CID 138968838
N-[[3-[[6-(2-fluoro-3-methoxyphenyl)-2-pyridinyl]oxy]phenyl]methyl]methanesulfonamide
CID 166628108
2-[3-(Difluoromethyl)-4-fluorophenoxy]-6-(2-fluoro-3-methoxyphenyl)pyridine
CID 166636269
6-(2,3-Dimethylphenoxy)-2-methylpyridin-3-amine
CID 79021266

Frequently Asked Questions

What is the IUPAC name of [6-[[6-(trifluoromethyl)-2-pyridinyl]oxy]-1,2,3,4-tetrahydronaphthalen-1-yl]methanamine?
The IUPAC name of [6-[[6-(trifluoromethyl)-2-pyridinyl]oxy]-1,2,3,4-tetrahydronaphthalen-1-yl]methanamine (CID 90242517) is [6-[[6-(trifluoromethyl)-2-pyridinyl]oxy]-1,2,3,4-tetrahydronaphthalen-1-yl]methanamine.
What is the SMILES notation for [6-[[6-(trifluoromethyl)-2-pyridinyl]oxy]-1,2,3,4-tetrahydronaphthalen-1-yl]methanamine?
The canonical SMILES for [6-[[6-(trifluoromethyl)-2-pyridinyl]oxy]-1,2,3,4-tetrahydronaphthalen-1-yl]methanamine is NCC1CCCc2cc(Oc3cccc(C(F)(F)F)n3)ccc21.
What is the InChIKey of [6-[[6-(trifluoromethyl)-2-pyridinyl]oxy]-1,2,3,4-tetrahydronaphthalen-1-yl]methanamine?
The InChIKey is OIZPJIRIQXOSSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17F3N2O/c18-17(19,20)15-5-2-6-16(22-15)23-13-7-8-14-11(9-13)3-1-4-12(14)10-21/h2,5-9,12H,1,3-4,10,21H2.
What are the key properties of [6-[[6-(trifluoromethyl)-2-pyridinyl]oxy]-1,2,3,4-tetrahydronaphthalen-1-yl]methanamine?
[6-[[6-(trifluoromethyl)-2-pyridinyl]oxy]-1,2,3,4-tetrahydronaphthalen-1-yl]methanamine has a molecular weight of 322.33 g/mol, XLogP of 4.27, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [6-[[6-(trifluoromethyl)-2-pyridinyl]oxy]-1,2,3,4-tetrahydronaphthalen-1-yl]methanamine is sourced from PubChem (CID 90242517), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).