N-(5-ethyl-1,2-oxazol-3-yl)-2-[4-[(7-methoxy-1,6-naphthyridin-4-yl)oxy]phenyl]acetamide

C22H20N4O4 — CID 24826071

IUPACN-(5-ethyl-1,2-oxazol-3-yl)-2-[4-[(7-methoxy-1,6-naphthyridin-4-yl)oxy]phenyl]acetamide
SMILESCCc1cc(NC(=O)Cc2ccc(Oc3ccnc4cc(OC)ncc34)cc2)no1
InChIInChI=1S/C22H20N4O4/c1-3-15-11-20(26-30-15)25-21(27)10-14-4-6-16(7-5-14)29-19-8-9-23-18-12-22(28-2)24-13-17(18)19/h4-9,11-13H,3,10H2,1-2H3,(H,25,26,27)
InChIKeyQZEZRTOAAIFVDJ-UHFFFAOYSA-N
MW404.43 g/mol
LogP4.16
Rot. Bonds7

About N-(5-ethyl-1,2-oxazol-3-yl)-2-[4-[(7-methoxy-1,6-naphthyridin-4-yl)oxy]phenyl]acetamide

N-(5-ethyl-1,2-oxazol-3-yl)-2-[4-[(7-methoxy-1,6-naphthyridin-4-yl)oxy]phenyl]acetamide (PubChem CID 24826071) has the molecular formula C22H20N4O4 and a molecular weight of 404.43 g/mol. Its IUPAC name is N-(5-ethyl-1,2-oxazol-3-yl)-2-[4-[(7-methoxy-1,6-naphthyridin-4-yl)oxy]phenyl]acetamide.

Molecular Properties

Compound NameN-(5-ethyl-1,2-oxazol-3-yl)-2-[4-[(7-methoxy-1,6-naphthyridin-4-yl)oxy]phenyl]acetamide
PubChem CID24826071
Molecular FormulaC22H20N4O4
Molecular Weight404.43 g/mol
Exact Mass404.15
IUPAC NameN-(5-ethyl-1,2-oxazol-3-yl)-2-[4-[(7-methoxy-1,6-naphthyridin-4-yl)oxy]phenyl]acetamide
SMILESCCc1cc(NC(=O)Cc2ccc(Oc3ccnc4cc(OC)ncc34)cc2)no1
InChIInChI=1S/C22H20N4O4/c1-3-15-11-20(26-30-15)25-21(27)10-14-4-6-16(7-5-14)29-19-8-9-23-18-12-22(28-2)24-13-17(18)19/h4-9,11-13H,3,10H2,1-2H3,(H,25,26,27)
InChIKeyQZEZRTOAAIFVDJ-UHFFFAOYSA-N
XLogP4.16
TPSA99.37 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds7
Heavy Atoms30
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500404.43
LogP ≤ 54.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of N-(5-ethyl-1,2-oxazol-3-yl)-2-[4-[(7-methoxy-1,6-naphthyridin-4-yl)oxy]phenyl]acetamide?
The IUPAC name of N-(5-ethyl-1,2-oxazol-3-yl)-2-[4-[(7-methoxy-1,6-naphthyridin-4-yl)oxy]phenyl]acetamide (CID 24826071) is N-(5-ethyl-1,2-oxazol-3-yl)-2-[4-[(7-methoxy-1,6-naphthyridin-4-yl)oxy]phenyl]acetamide.
What is the SMILES notation for N-(5-ethyl-1,2-oxazol-3-yl)-2-[4-[(7-methoxy-1,6-naphthyridin-4-yl)oxy]phenyl]acetamide?
The canonical SMILES for N-(5-ethyl-1,2-oxazol-3-yl)-2-[4-[(7-methoxy-1,6-naphthyridin-4-yl)oxy]phenyl]acetamide is CCc1cc(NC(=O)Cc2ccc(Oc3ccnc4cc(OC)ncc34)cc2)no1.
What is the InChIKey of N-(5-ethyl-1,2-oxazol-3-yl)-2-[4-[(7-methoxy-1,6-naphthyridin-4-yl)oxy]phenyl]acetamide?
The InChIKey is QZEZRTOAAIFVDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H20N4O4/c1-3-15-11-20(26-30-15)25-21(27)10-14-4-6-16(7-5-14)29-19-8-9-23-18-12-22(28-2)24-13-17(18)19/h4-9,11-13H,3,10H2,1-2H3,(H,25,26,27).
What are the key properties of N-(5-ethyl-1,2-oxazol-3-yl)-2-[4-[(7-methoxy-1,6-naphthyridin-4-yl)oxy]phenyl]acetamide?
N-(5-ethyl-1,2-oxazol-3-yl)-2-[4-[(7-methoxy-1,6-naphthyridin-4-yl)oxy]phenyl]acetamide has a molecular weight of 404.43 g/mol, XLogP of 4.16, 7 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-ethyl-1,2-oxazol-3-yl)-2-[4-[(7-methoxy-1,6-naphthyridin-4-yl)oxy]phenyl]acetamide is sourced from PubChem (CID 24826071), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).