2-ethyl-N-methyl-6-(2,2,2-trifluoroethoxy)quinolin-4-amine

C14H15F3N2O — CID 62203229

IUPAC2-ethyl-N-methyl-6-(2,2,2-trifluoroethoxy)quinolin-4-amine
SMILESCCc1cc(NC)c2cc(OCC(F)(F)F)ccc2n1
InChIInChI=1S/C14H15F3N2O/c1-3-9-6-13(18-2)11-7-10(4-5-12(11)19-9)20-8-14(15,16)17/h4-7H,3,8H2,1-2H3,(H,18,19)
InChIKeyYOMINMKOZCFPDW-UHFFFAOYSA-N
MW284.28 g/mol
LogP3.78
Rot. Bonds4

About 2-ethyl-N-methyl-6-(2,2,2-trifluoroethoxy)quinolin-4-amine

2-ethyl-N-methyl-6-(2,2,2-trifluoroethoxy)quinolin-4-amine (PubChem CID 62203229) has the molecular formula C14H15F3N2O and a molecular weight of 284.28 g/mol. Its IUPAC name is 2-ethyl-N-methyl-6-(2,2,2-trifluoroethoxy)quinolin-4-amine.

Molecular Properties

Compound Name2-ethyl-N-methyl-6-(2,2,2-trifluoroethoxy)quinolin-4-amine
PubChem CID62203229
Molecular FormulaC14H15F3N2O
Molecular Weight284.28 g/mol
Exact Mass284.11
IUPAC Name2-ethyl-N-methyl-6-(2,2,2-trifluoroethoxy)quinolin-4-amine
SMILESCCc1cc(NC)c2cc(OCC(F)(F)F)ccc2n1
InChIInChI=1S/C14H15F3N2O/c1-3-9-6-13(18-2)11-7-10(4-5-12(11)19-9)20-8-14(15,16)17/h4-7H,3,8H2,1-2H3,(H,18,19)
InChIKeyYOMINMKOZCFPDW-UHFFFAOYSA-N
XLogP3.78
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.28
LogP ≤ 53.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-ethyl-N-methyl-6-(2,2,2-trifluoroethoxy)quinolin-4-amine?
The IUPAC name of 2-ethyl-N-methyl-6-(2,2,2-trifluoroethoxy)quinolin-4-amine (CID 62203229) is 2-ethyl-N-methyl-6-(2,2,2-trifluoroethoxy)quinolin-4-amine.
What is the SMILES notation for 2-ethyl-N-methyl-6-(2,2,2-trifluoroethoxy)quinolin-4-amine?
The canonical SMILES for 2-ethyl-N-methyl-6-(2,2,2-trifluoroethoxy)quinolin-4-amine is CCc1cc(NC)c2cc(OCC(F)(F)F)ccc2n1.
What is the InChIKey of 2-ethyl-N-methyl-6-(2,2,2-trifluoroethoxy)quinolin-4-amine?
The InChIKey is YOMINMKOZCFPDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15F3N2O/c1-3-9-6-13(18-2)11-7-10(4-5-12(11)19-9)20-8-14(15,16)17/h4-7H,3,8H2,1-2H3,(H,18,19).
What are the key properties of 2-ethyl-N-methyl-6-(2,2,2-trifluoroethoxy)quinolin-4-amine?
2-ethyl-N-methyl-6-(2,2,2-trifluoroethoxy)quinolin-4-amine has a molecular weight of 284.28 g/mol, XLogP of 3.78, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-N-methyl-6-(2,2,2-trifluoroethoxy)quinolin-4-amine is sourced from PubChem (CID 62203229), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).