2-ethenyl-5-methyl-N-[3-(trifluoromethyl)phenyl]pyridin-4-amine

C15H13F3N2 — CID 155344346

IUPAC2-ethenyl-5-methyl-N-[3-(trifluoromethyl)phenyl]pyridin-4-amine
SMILESC=Cc1cc(Nc2cccc(C(F)(F)F)c2)c(C)cn1
InChIInChI=1S/C15H13F3N2/c1-3-12-8-14(10(2)9-19-12)20-13-6-4-5-11(7-13)15(16,17)18/h3-9H,1H2,2H3,(H,19,20)
InChIKeyNUOLZVMHCIFACA-UHFFFAOYSA-N
MW278.28 g/mol
LogP4.80
Rot. Bonds3

About 2-ethenyl-5-methyl-N-[3-(trifluoromethyl)phenyl]pyridin-4-amine

2-ethenyl-5-methyl-N-[3-(trifluoromethyl)phenyl]pyridin-4-amine (PubChem CID 155344346) has the molecular formula C15H13F3N2 and a molecular weight of 278.28 g/mol. Its IUPAC name is 2-ethenyl-5-methyl-N-[3-(trifluoromethyl)phenyl]pyridin-4-amine.

Molecular Properties

Compound Name2-ethenyl-5-methyl-N-[3-(trifluoromethyl)phenyl]pyridin-4-amine
PubChem CID155344346
Molecular FormulaC15H13F3N2
Molecular Weight278.28 g/mol
Exact Mass278.10
IUPAC Name2-ethenyl-5-methyl-N-[3-(trifluoromethyl)phenyl]pyridin-4-amine
SMILESC=Cc1cc(Nc2cccc(C(F)(F)F)c2)c(C)cn1
InChIInChI=1S/C15H13F3N2/c1-3-12-8-14(10(2)9-19-12)20-13-6-4-5-11(7-13)15(16,17)18/h3-9H,1H2,2H3,(H,19,20)
InChIKeyNUOLZVMHCIFACA-UHFFFAOYSA-N
XLogP4.80
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.28
LogP ≤ 54.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-ethenyl-5-methyl-N-[3-(trifluoromethyl)phenyl]pyridin-4-amine?
The IUPAC name of 2-ethenyl-5-methyl-N-[3-(trifluoromethyl)phenyl]pyridin-4-amine (CID 155344346) is 2-ethenyl-5-methyl-N-[3-(trifluoromethyl)phenyl]pyridin-4-amine.
What is the SMILES notation for 2-ethenyl-5-methyl-N-[3-(trifluoromethyl)phenyl]pyridin-4-amine?
The canonical SMILES for 2-ethenyl-5-methyl-N-[3-(trifluoromethyl)phenyl]pyridin-4-amine is C=Cc1cc(Nc2cccc(C(F)(F)F)c2)c(C)cn1.
What is the InChIKey of 2-ethenyl-5-methyl-N-[3-(trifluoromethyl)phenyl]pyridin-4-amine?
The InChIKey is NUOLZVMHCIFACA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13F3N2/c1-3-12-8-14(10(2)9-19-12)20-13-6-4-5-11(7-13)15(16,17)18/h3-9H,1H2,2H3,(H,19,20).
What are the key properties of 2-ethenyl-5-methyl-N-[3-(trifluoromethyl)phenyl]pyridin-4-amine?
2-ethenyl-5-methyl-N-[3-(trifluoromethyl)phenyl]pyridin-4-amine has a molecular weight of 278.28 g/mol, XLogP of 4.80, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethenyl-5-methyl-N-[3-(trifluoromethyl)phenyl]pyridin-4-amine is sourced from PubChem (CID 155344346), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).