N-methyl-1-pyridin-2-yl-2-[3-(trifluoromethyl)phenyl]ethanamine

C15H15F3N2 — CID 62600521

IUPACN-methyl-1-pyridin-2-yl-2-[3-(trifluoromethyl)phenyl]ethanamine
SMILESCNC(Cc1cccc(C(F)(F)F)c1)c1ccccn1
InChIInChI=1S/C15H15F3N2/c1-19-14(13-7-2-3-8-20-13)10-11-5-4-6-12(9-11)15(16,17)18/h2-9,14,19H,10H2,1H3
InChIKeyCFEQMIHPQVVLNX-UHFFFAOYSA-N
MW280.29 g/mol
LogP3.60
Rot. Bonds4

About N-methyl-1-pyridin-2-yl-2-[3-(trifluoromethyl)phenyl]ethanamine

N-methyl-1-pyridin-2-yl-2-[3-(trifluoromethyl)phenyl]ethanamine (PubChem CID 62600521) has the molecular formula C15H15F3N2 and a molecular weight of 280.29 g/mol. Its IUPAC name is N-methyl-1-pyridin-2-yl-2-[3-(trifluoromethyl)phenyl]ethanamine.

Molecular Properties

Compound NameN-methyl-1-pyridin-2-yl-2-[3-(trifluoromethyl)phenyl]ethanamine
PubChem CID62600521
Molecular FormulaC15H15F3N2
Molecular Weight280.29 g/mol
Exact Mass280.12
IUPAC NameN-methyl-1-pyridin-2-yl-2-[3-(trifluoromethyl)phenyl]ethanamine
SMILESCNC(Cc1cccc(C(F)(F)F)c1)c1ccccn1
InChIInChI=1S/C15H15F3N2/c1-19-14(13-7-2-3-8-20-13)10-11-5-4-6-12(9-11)15(16,17)18/h2-9,14,19H,10H2,1H3
InChIKeyCFEQMIHPQVVLNX-UHFFFAOYSA-N
XLogP3.60
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.29
LogP ≤ 53.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(3,4-dichlorophenyl)-N-methyl-1-pyridin-2-ylethanamine
CID 62601667
N-methyl-1-(4-methyl-3-pyridinyl)-2-[3-(trifluoromethyl)phenyl]ethanamine
CID 66273581
2-(3-chlorophenyl)-N-methyl-1-[5-(trifluoromethyl)-2-pyridinyl]ethanamine
CID 105085844
1-(furan-2-yl)-N-methyl-2-[3-(trifluoromethyl)phenyl]ethanamine
CID 62717333
1-(4-iodophenyl)-N-methyl-2-[3-(trifluoromethyl)phenyl]ethanamine
CID 115830875
2-[[3-(trifluoromethyl)phenyl]methyl]pyrimidine
CID 121010377
1,1,1-trifluoro-N-methyl-3-[3-(trifluoromethyl)phenyl]propan-2-amine
CID 66468158
N-ethyl-1-pyridin-4-yl-2-[3-(trifluoromethyl)phenyl]ethanamine
CID 62602438
3-[1-hydrazinyl-2-[3-(trifluoromethyl)phenyl]ethyl]pyridin-2-amine
CID 105235141
1-(3-chloro-4-methylthiophen-2-yl)-N-methyl-2-[3-(trifluoromethyl)phenyl]ethanamine
CID 103405485
(2S)-N-(pyridin-4-ylmethyl)-1-[3-(trifluoromethyl)phenyl]propan-2-amine
CID 42563452
1-(2,5-dibromothiophen-3-yl)-N-methyl-2-[3-(trifluoromethyl)phenyl]ethanamine
CID 107968090

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-pyridin-2-yl-2-[3-(trifluoromethyl)phenyl]ethanamine?
The IUPAC name of N-methyl-1-pyridin-2-yl-2-[3-(trifluoromethyl)phenyl]ethanamine (CID 62600521) is N-methyl-1-pyridin-2-yl-2-[3-(trifluoromethyl)phenyl]ethanamine.
What is the SMILES notation for N-methyl-1-pyridin-2-yl-2-[3-(trifluoromethyl)phenyl]ethanamine?
The canonical SMILES for N-methyl-1-pyridin-2-yl-2-[3-(trifluoromethyl)phenyl]ethanamine is CNC(Cc1cccc(C(F)(F)F)c1)c1ccccn1.
What is the InChIKey of N-methyl-1-pyridin-2-yl-2-[3-(trifluoromethyl)phenyl]ethanamine?
The InChIKey is CFEQMIHPQVVLNX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15F3N2/c1-19-14(13-7-2-3-8-20-13)10-11-5-4-6-12(9-11)15(16,17)18/h2-9,14,19H,10H2,1H3.
What are the key properties of N-methyl-1-pyridin-2-yl-2-[3-(trifluoromethyl)phenyl]ethanamine?
N-methyl-1-pyridin-2-yl-2-[3-(trifluoromethyl)phenyl]ethanamine has a molecular weight of 280.29 g/mol, XLogP of 3.60, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-pyridin-2-yl-2-[3-(trifluoromethyl)phenyl]ethanamine is sourced from PubChem (CID 62600521), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).