4-[2-[[4-[2-(5-chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]-2,7-naphthyridin-1-yl]oxy]ethyl]morpholine

C28H23ClFN5O2 — CID 56592467

IUPAC4-[2-[[4-[2-(5-chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]-2,7-naphthyridin-1-yl]oxy]ethyl]morpholine
SMILESFc1ccc(Cl)cc1-c1cc(-c2cnc(OCCN3CCOCC3)c3cnccc23)c2cccnc2n1
InChIInChI=1S/C28H23ClFN5O2/c29-18-3-4-25(30)22(14-18)26-15-21(20-2-1-6-32-27(20)34-26)23-17-33-28(24-16-31-7-5-19(23)24)37-13-10-35-8-11-36-12-9-35/h1-7,14-17H,8-13H2
InChIKeyNFMYOIQXTKEGRK-UHFFFAOYSA-N
MW515.98 g/mol
LogP5.41
Rot. Bonds6

About 4-[2-[[4-[2-(5-chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]-2,7-naphthyridin-1-yl]oxy]ethyl]morpholine

4-[2-[[4-[2-(5-chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]-2,7-naphthyridin-1-yl]oxy]ethyl]morpholine (PubChem CID 56592467) has the molecular formula C28H23ClFN5O2 and a molecular weight of 515.98 g/mol. Its IUPAC name is 4-[2-[[4-[2-(5-chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]-2,7-naphthyridin-1-yl]oxy]ethyl]morpholine.

Molecular Properties

Compound Name4-[2-[[4-[2-(5-chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]-2,7-naphthyridin-1-yl]oxy]ethyl]morpholine
PubChem CID56592467
Molecular FormulaC28H23ClFN5O2
Molecular Weight515.98 g/mol
Exact Mass515.15
IUPAC Name4-[2-[[4-[2-(5-chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]-2,7-naphthyridin-1-yl]oxy]ethyl]morpholine
SMILESFc1ccc(Cl)cc1-c1cc(-c2cnc(OCCN3CCOCC3)c3cnccc23)c2cccnc2n1
InChIInChI=1S/C28H23ClFN5O2/c29-18-3-4-25(30)22(14-18)26-15-21(20-2-1-6-32-27(20)34-26)23-17-33-28(24-16-31-7-5-19(23)24)37-13-10-35-8-11-36-12-9-35/h1-7,14-17H,8-13H2
InChIKeyNFMYOIQXTKEGRK-UHFFFAOYSA-N
XLogP5.41
TPSA73.26 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms37
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500515.98
LogP ≤ 55.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Analyze 4-[2-[[4-[2-(5-chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]-2,7-naphthyridin-1-yl]oxy]ethyl]morpholine 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 4-[2-[[4-[2-(5-chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]-2,7-naphthyridin-1-yl]oxy]ethyl]morpholine?
The IUPAC name of 4-[2-[[4-[2-(5-chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]-2,7-naphthyridin-1-yl]oxy]ethyl]morpholine (CID 56592467) is 4-[2-[[4-[2-(5-chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]-2,7-naphthyridin-1-yl]oxy]ethyl]morpholine.
What is the SMILES notation for 4-[2-[[4-[2-(5-chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]-2,7-naphthyridin-1-yl]oxy]ethyl]morpholine?
The canonical SMILES for 4-[2-[[4-[2-(5-chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]-2,7-naphthyridin-1-yl]oxy]ethyl]morpholine is Fc1ccc(Cl)cc1-c1cc(-c2cnc(OCCN3CCOCC3)c3cnccc23)c2cccnc2n1.
What is the InChIKey of 4-[2-[[4-[2-(5-chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]-2,7-naphthyridin-1-yl]oxy]ethyl]morpholine?
The InChIKey is NFMYOIQXTKEGRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H23ClFN5O2/c29-18-3-4-25(30)22(14-18)26-15-21(20-2-1-6-32-27(20)34-26)23-17-33-28(24-16-31-7-5-19(23)24)37-13-10-35-8-11-36-12-9-35/h1-7,14-17H,8-13H2.
What are the key properties of 4-[2-[[4-[2-(5-chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]-2,7-naphthyridin-1-yl]oxy]ethyl]morpholine?
4-[2-[[4-[2-(5-chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]-2,7-naphthyridin-1-yl]oxy]ethyl]morpholine has a molecular weight of 515.98 g/mol, XLogP of 5.41, 6 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-[[4-[2-(5-chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]-2,7-naphthyridin-1-yl]oxy]ethyl]morpholine is sourced from PubChem (CID 56592467), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).