7-[3-(2-fluoroethoxy)azetidin-1-yl]-N-(5-propan-2-ylpyridazin-3-yl)-1,5-naphthyridin-2-amine

C20H23FN6O — CID 90289554

IUPAC7-[3-(2-fluoroethoxy)azetidin-1-yl]-N-(5-propan-2-ylpyridazin-3-yl)-1,5-naphthyridin-2-amine
SMILESCC(C)c1cnnc(Nc2ccc3ncc(N4CC(OCCF)C4)cc3n2)c1
InChIInChI=1S/C20H23FN6O/c1-13(2)14-7-20(26-23-9-14)25-19-4-3-17-18(24-19)8-15(10-22-17)27-11-16(12-27)28-6-5-21/h3-4,7-10,13,16H,5-6,11-12H2,1-2H3,(H,24,25,26)
InChIKeyNGLKCIVAAGHOTO-UHFFFAOYSA-N
MW382.44 g/mol
LogP3.46
Rot. Bonds7

About 7-[3-(2-fluoroethoxy)azetidin-1-yl]-N-(5-propan-2-ylpyridazin-3-yl)-1,5-naphthyridin-2-amine

7-[3-(2-fluoroethoxy)azetidin-1-yl]-N-(5-propan-2-ylpyridazin-3-yl)-1,5-naphthyridin-2-amine (PubChem CID 90289554) has the molecular formula C20H23FN6O and a molecular weight of 382.44 g/mol. Its IUPAC name is 7-[3-(2-fluoroethoxy)azetidin-1-yl]-N-(5-propan-2-ylpyridazin-3-yl)-1,5-naphthyridin-2-amine.

Molecular Properties

Compound Name7-[3-(2-fluoroethoxy)azetidin-1-yl]-N-(5-propan-2-ylpyridazin-3-yl)-1,5-naphthyridin-2-amine
PubChem CID90289554
Molecular FormulaC20H23FN6O
Molecular Weight382.44 g/mol
Exact Mass382.19
IUPAC Name7-[3-(2-fluoroethoxy)azetidin-1-yl]-N-(5-propan-2-ylpyridazin-3-yl)-1,5-naphthyridin-2-amine
SMILESCC(C)c1cnnc(Nc2ccc3ncc(N4CC(OCCF)C4)cc3n2)c1
InChIInChI=1S/C20H23FN6O/c1-13(2)14-7-20(26-23-9-14)25-19-4-3-17-18(24-19)8-15(10-22-17)27-11-16(12-27)28-6-5-21/h3-4,7-10,13,16H,5-6,11-12H2,1-2H3,(H,24,25,26)
InChIKeyNGLKCIVAAGHOTO-UHFFFAOYSA-N
XLogP3.46
TPSA76.06 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500382.44
LogP ≤ 53.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze 7-[3-(2-fluoroethoxy)azetidin-1-yl]-N-(5-propan-2-ylpyridazin-3-yl)-1,5-naphthyridin-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 7-[3-(2-fluoroethoxy)azetidin-1-yl]-N-(5-propan-2-ylpyridazin-3-yl)-1,5-naphthyridin-2-amine?
The IUPAC name of 7-[3-(2-fluoroethoxy)azetidin-1-yl]-N-(5-propan-2-ylpyridazin-3-yl)-1,5-naphthyridin-2-amine (CID 90289554) is 7-[3-(2-fluoroethoxy)azetidin-1-yl]-N-(5-propan-2-ylpyridazin-3-yl)-1,5-naphthyridin-2-amine.
What is the SMILES notation for 7-[3-(2-fluoroethoxy)azetidin-1-yl]-N-(5-propan-2-ylpyridazin-3-yl)-1,5-naphthyridin-2-amine?
The canonical SMILES for 7-[3-(2-fluoroethoxy)azetidin-1-yl]-N-(5-propan-2-ylpyridazin-3-yl)-1,5-naphthyridin-2-amine is CC(C)c1cnnc(Nc2ccc3ncc(N4CC(OCCF)C4)cc3n2)c1.
What is the InChIKey of 7-[3-(2-fluoroethoxy)azetidin-1-yl]-N-(5-propan-2-ylpyridazin-3-yl)-1,5-naphthyridin-2-amine?
The InChIKey is NGLKCIVAAGHOTO-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23FN6O/c1-13(2)14-7-20(26-23-9-14)25-19-4-3-17-18(24-19)8-15(10-22-17)27-11-16(12-27)28-6-5-21/h3-4,7-10,13,16H,5-6,11-12H2,1-2H3,(H,24,25,26).
What are the key properties of 7-[3-(2-fluoroethoxy)azetidin-1-yl]-N-(5-propan-2-ylpyridazin-3-yl)-1,5-naphthyridin-2-amine?
7-[3-(2-fluoroethoxy)azetidin-1-yl]-N-(5-propan-2-ylpyridazin-3-yl)-1,5-naphthyridin-2-amine has a molecular weight of 382.44 g/mol, XLogP of 3.46, 7 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 7-[3-(2-fluoroethoxy)azetidin-1-yl]-N-(5-propan-2-ylpyridazin-3-yl)-1,5-naphthyridin-2-amine is sourced from PubChem (CID 90289554), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).