2-(2-methoxyphenyl)-1-[3-(trifluoromethyl)-2-pyridinyl]ethanamine

C15H15F3N2O — CID 78018930

IUPAC2-(2-methoxyphenyl)-1-[3-(trifluoromethyl)-2-pyridinyl]ethanamine
SMILESCOc1ccccc1CC(N)c1ncccc1C(F)(F)F
InChIInChI=1S/C15H15F3N2O/c1-21-13-7-3-2-5-10(13)9-12(19)14-11(15(16,17)18)6-4-8-20-14/h2-8,12H,9,19H2,1H3
InChIKeyPGOFAXAHBYWQGB-UHFFFAOYSA-N
MW296.29 g/mol
LogP3.35
Rot. Bonds4

About 2-(2-methoxyphenyl)-1-[3-(trifluoromethyl)-2-pyridinyl]ethanamine

2-(2-methoxyphenyl)-1-[3-(trifluoromethyl)-2-pyridinyl]ethanamine (PubChem CID 78018930) has the molecular formula C15H15F3N2O and a molecular weight of 296.29 g/mol. Its IUPAC name is 2-(2-methoxyphenyl)-1-[3-(trifluoromethyl)-2-pyridinyl]ethanamine.

Molecular Properties

Compound Name2-(2-methoxyphenyl)-1-[3-(trifluoromethyl)-2-pyridinyl]ethanamine
PubChem CID78018930
Molecular FormulaC15H15F3N2O
Molecular Weight296.29 g/mol
Exact Mass296.11
IUPAC Name2-(2-methoxyphenyl)-1-[3-(trifluoromethyl)-2-pyridinyl]ethanamine
SMILESCOc1ccccc1CC(N)c1ncccc1C(F)(F)F
InChIInChI=1S/C15H15F3N2O/c1-21-13-7-3-2-5-10(13)9-12(19)14-11(15(16,17)18)6-4-8-20-14/h2-8,12H,9,19H2,1H3
InChIKeyPGOFAXAHBYWQGB-UHFFFAOYSA-N
XLogP3.35
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.29
LogP ≤ 53.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(3-chloro-2-pyridinyl)-2-(2-fluoro-3-methoxyphenyl)ethanamine
CID 103443769
(2S)-2-amino-2-[3-(trifluoromethyl)-2-pyridinyl]ethanol
CID 131168070
1-(3-methoxy-2-pyridinyl)-2-(2,2,2-trifluoroethoxy)ethanamine
CID 114054015
(1R)-1,2-bis(2-methoxyphenyl)ethanamine
CID 40618713
(1S)-1,2-bis(2-methoxyphenyl)ethanamine
CID 36689288
(1S)-1-[3-(trifluoromethyl)-2-pyridinyl]ethanamine
CID 131017310
2-(2-methoxyphenyl)-1-pyridin-3-ylethanamine
CID 22299211
1-(1-ethylimidazol-2-yl)-2-(2-methoxyphenyl)ethanamine
CID 63970215
2,2-difluoro-1-(3-methoxy-2-pyridinyl)propan-1-amine
CID 130650453
2-propan-2-yl-3-(trifluoromethyl)pyridine
CID 59735101
(2R)-2-amino-2-(3-methoxy-2-pyridinyl)ethanol
CID 96850177
2-(2-methoxyphenyl)-1-(1-methylindazol-3-yl)ethanamine
CID 103126355

Frequently Asked Questions

What is the IUPAC name of 2-(2-methoxyphenyl)-1-[3-(trifluoromethyl)-2-pyridinyl]ethanamine?
The IUPAC name of 2-(2-methoxyphenyl)-1-[3-(trifluoromethyl)-2-pyridinyl]ethanamine (CID 78018930) is 2-(2-methoxyphenyl)-1-[3-(trifluoromethyl)-2-pyridinyl]ethanamine.
What is the SMILES notation for 2-(2-methoxyphenyl)-1-[3-(trifluoromethyl)-2-pyridinyl]ethanamine?
The canonical SMILES for 2-(2-methoxyphenyl)-1-[3-(trifluoromethyl)-2-pyridinyl]ethanamine is COc1ccccc1CC(N)c1ncccc1C(F)(F)F.
What is the InChIKey of 2-(2-methoxyphenyl)-1-[3-(trifluoromethyl)-2-pyridinyl]ethanamine?
The InChIKey is PGOFAXAHBYWQGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15F3N2O/c1-21-13-7-3-2-5-10(13)9-12(19)14-11(15(16,17)18)6-4-8-20-14/h2-8,12H,9,19H2,1H3.
What are the key properties of 2-(2-methoxyphenyl)-1-[3-(trifluoromethyl)-2-pyridinyl]ethanamine?
2-(2-methoxyphenyl)-1-[3-(trifluoromethyl)-2-pyridinyl]ethanamine has a molecular weight of 296.29 g/mol, XLogP of 3.35, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxyphenyl)-1-[3-(trifluoromethyl)-2-pyridinyl]ethanamine is sourced from PubChem (CID 78018930), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).