7-ethoxy-1-ethyl-2-phenyl-1,8-naphthyridin-4-one

C18H18N2O2 — CID 11266371

IUPAC7-ethoxy-1-ethyl-2-phenyl-1,8-naphthyridin-4-one
SMILESCCOc1ccc2c(=O)cc(-c3ccccc3)n(CC)c2n1
InChIInChI=1S/C18H18N2O2/c1-3-20-15(13-8-6-5-7-9-13)12-16(21)14-10-11-17(22-4-2)19-18(14)20/h5-12H,3-4H2,1-2H3
InChIKeyJKRWRMYTHHNAOF-UHFFFAOYSA-N
MW294.35 g/mol
LogP3.48
Rot. Bonds4

About 7-ethoxy-1-ethyl-2-phenyl-1,8-naphthyridin-4-one

7-ethoxy-1-ethyl-2-phenyl-1,8-naphthyridin-4-one (PubChem CID 11266371) has the molecular formula C18H18N2O2 and a molecular weight of 294.35 g/mol. Its IUPAC name is 7-ethoxy-1-ethyl-2-phenyl-1,8-naphthyridin-4-one.

Molecular Properties

Compound Name7-ethoxy-1-ethyl-2-phenyl-1,8-naphthyridin-4-one
PubChem CID11266371
Molecular FormulaC18H18N2O2
Molecular Weight294.35 g/mol
Exact Mass294.14
IUPAC Name7-ethoxy-1-ethyl-2-phenyl-1,8-naphthyridin-4-one
SMILESCCOc1ccc2c(=O)cc(-c3ccccc3)n(CC)c2n1
InChIInChI=1S/C18H18N2O2/c1-3-20-15(13-8-6-5-7-9-13)12-16(21)14-10-11-17(22-4-2)19-18(14)20/h5-12H,3-4H2,1-2H3
InChIKeyJKRWRMYTHHNAOF-UHFFFAOYSA-N
XLogP3.48
TPSA44.12 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.35
LogP ≤ 53.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 7-ethoxy-1-ethyl-2-phenyl-1,8-naphthyridin-4-one?
The IUPAC name of 7-ethoxy-1-ethyl-2-phenyl-1,8-naphthyridin-4-one (CID 11266371) is 7-ethoxy-1-ethyl-2-phenyl-1,8-naphthyridin-4-one.
What is the SMILES notation for 7-ethoxy-1-ethyl-2-phenyl-1,8-naphthyridin-4-one?
The canonical SMILES for 7-ethoxy-1-ethyl-2-phenyl-1,8-naphthyridin-4-one is CCOc1ccc2c(=O)cc(-c3ccccc3)n(CC)c2n1.
What is the InChIKey of 7-ethoxy-1-ethyl-2-phenyl-1,8-naphthyridin-4-one?
The InChIKey is JKRWRMYTHHNAOF-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N2O2/c1-3-20-15(13-8-6-5-7-9-13)12-16(21)14-10-11-17(22-4-2)19-18(14)20/h5-12H,3-4H2,1-2H3.
What are the key properties of 7-ethoxy-1-ethyl-2-phenyl-1,8-naphthyridin-4-one?
7-ethoxy-1-ethyl-2-phenyl-1,8-naphthyridin-4-one has a molecular weight of 294.35 g/mol, XLogP of 3.48, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-ethoxy-1-ethyl-2-phenyl-1,8-naphthyridin-4-one is sourced from PubChem (CID 11266371), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).