3-(2,2,2-trifluoro-1-pyridin-3-ylethoxy)-1,7-naphthyridin-2-amine

C15H11F3N4O — CID 150800960

IUPAC3-(2,2,2-trifluoro-1-pyridin-3-ylethoxy)-1,7-naphthyridin-2-amine
SMILESNc1nc2cnccc2cc1OC(c1cccnc1)C(F)(F)F
InChIInChI=1S/C15H11F3N4O/c16-15(17,18)13(10-2-1-4-20-7-10)23-12-6-9-3-5-21-8-11(9)22-14(12)19/h1-8,13H,(H2,19,22)
InChIKeyKFVUGHCBIRFUJN-UHFFFAOYSA-N
MW320.27 g/mol
LogP3.29
Rot. Bonds3

About 3-(2,2,2-trifluoro-1-pyridin-3-ylethoxy)-1,7-naphthyridin-2-amine

3-(2,2,2-trifluoro-1-pyridin-3-ylethoxy)-1,7-naphthyridin-2-amine (PubChem CID 150800960) has the molecular formula C15H11F3N4O and a molecular weight of 320.27 g/mol. Its IUPAC name is 3-(2,2,2-trifluoro-1-pyridin-3-ylethoxy)-1,7-naphthyridin-2-amine.

Molecular Properties

Compound Name3-(2,2,2-trifluoro-1-pyridin-3-ylethoxy)-1,7-naphthyridin-2-amine
PubChem CID150800960
Molecular FormulaC15H11F3N4O
Molecular Weight320.27 g/mol
Exact Mass320.09
IUPAC Name3-(2,2,2-trifluoro-1-pyridin-3-ylethoxy)-1,7-naphthyridin-2-amine
SMILESNc1nc2cnccc2cc1OC(c1cccnc1)C(F)(F)F
InChIInChI=1S/C15H11F3N4O/c16-15(17,18)13(10-2-1-4-20-7-10)23-12-6-9-3-5-21-8-11(9)22-14(12)19/h1-8,13H,(H2,19,22)
InChIKeyKFVUGHCBIRFUJN-UHFFFAOYSA-N
XLogP3.29
TPSA73.92 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.27
LogP ≤ 53.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-(2,2,2-trifluoro-1-pyridin-3-ylethoxy)quinolin-3-amine
CID 67402088
CID 58450224
CID 58450224
(1R)-2,2,3,3,3-pentafluoro-1-pyridin-3-ylpropan-1-amine
CID 131371192
N-[3-(2,2,2-trifluoro-1-pyridin-3-ylethoxy)quinoxalin-2-yl]pyridine-3-sulfonamide
CID 67402942
1-pyridin-3-yl-2-(2,2,2-trifluoroethoxy)ethanamine
CID 103214655
2-(trifluoromethoxy)-N-[3-(2,2,2-trifluoro-1-pyridin-3-ylethoxy)quinoxalin-2-yl]benzenesulfonamide
CID 87386193
[(1R)-2,2,2-trifluoro-1-pyridin-3-ylethyl] cyclobutanecarboxylate
CID 95616017
(2,2,2-trifluoro-1-pyridin-3-ylethyl) furan-2-sulfonate
CID 167743029
[(1S)-2,2,2-trifluoro-1-pyridin-3-ylethyl] furan-2-carboxylate
CID 95616020
2,2,2-trifluoro-N-methyl-1-pyridin-3-ylethanamine
CID 55273393
amino(pyridin-3-yl)methanethiol
CID 116939546
7-propan-2-yl-3-pyridin-3-ylquinolin-2-amine
CID 155185229

Frequently Asked Questions

What is the IUPAC name of 3-(2,2,2-trifluoro-1-pyridin-3-ylethoxy)-1,7-naphthyridin-2-amine?
The IUPAC name of 3-(2,2,2-trifluoro-1-pyridin-3-ylethoxy)-1,7-naphthyridin-2-amine (CID 150800960) is 3-(2,2,2-trifluoro-1-pyridin-3-ylethoxy)-1,7-naphthyridin-2-amine.
What is the SMILES notation for 3-(2,2,2-trifluoro-1-pyridin-3-ylethoxy)-1,7-naphthyridin-2-amine?
The canonical SMILES for 3-(2,2,2-trifluoro-1-pyridin-3-ylethoxy)-1,7-naphthyridin-2-amine is Nc1nc2cnccc2cc1OC(c1cccnc1)C(F)(F)F.
What is the InChIKey of 3-(2,2,2-trifluoro-1-pyridin-3-ylethoxy)-1,7-naphthyridin-2-amine?
The InChIKey is KFVUGHCBIRFUJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11F3N4O/c16-15(17,18)13(10-2-1-4-20-7-10)23-12-6-9-3-5-21-8-11(9)22-14(12)19/h1-8,13H,(H2,19,22).
What are the key properties of 3-(2,2,2-trifluoro-1-pyridin-3-ylethoxy)-1,7-naphthyridin-2-amine?
3-(2,2,2-trifluoro-1-pyridin-3-ylethoxy)-1,7-naphthyridin-2-amine has a molecular weight of 320.27 g/mol, XLogP of 3.29, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,2,2-trifluoro-1-pyridin-3-ylethoxy)-1,7-naphthyridin-2-amine is sourced from PubChem (CID 150800960), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).