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

C16H14N2O2 — CID 10706862

IUPAC7-ethoxy-2-phenyl-1H-1,8-naphthyridin-4-one
SMILESCCOc1ccc2c(=O)cc(-c3ccccc3)[nH]c2n1
InChIInChI=1S/C16H14N2O2/c1-2-20-15-9-8-12-14(19)10-13(17-16(12)18-15)11-6-4-3-5-7-11/h3-10H,2H2,1H3,(H,17,18,19)
InChIKeyXFBOFPZZZNBLGG-UHFFFAOYSA-N
MW266.30 g/mol
LogP2.99
Rot. Bonds3

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

7-ethoxy-2-phenyl-1H-1,8-naphthyridin-4-one (PubChem CID 10706862) has the molecular formula C16H14N2O2 and a molecular weight of 266.30 g/mol. Its IUPAC name is 7-ethoxy-2-phenyl-1H-1,8-naphthyridin-4-one.

Molecular Properties

Compound Name7-ethoxy-2-phenyl-1H-1,8-naphthyridin-4-one
PubChem CID10706862
Molecular FormulaC16H14N2O2
Molecular Weight266.30 g/mol
Exact Mass266.11
IUPAC Name7-ethoxy-2-phenyl-1H-1,8-naphthyridin-4-one
SMILESCCOc1ccc2c(=O)cc(-c3ccccc3)[nH]c2n1
InChIInChI=1S/C16H14N2O2/c1-2-20-15-9-8-12-14(19)10-13(17-16(12)18-15)11-6-4-3-5-7-11/h3-10H,2H2,1H3,(H,17,18,19)
InChIKeyXFBOFPZZZNBLGG-UHFFFAOYSA-N
XLogP2.99
TPSA54.98 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.30
LogP ≤ 52.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 7-ethoxy-2-phenyl-1H-1,8-naphthyridin-4-one?
The IUPAC name of 7-ethoxy-2-phenyl-1H-1,8-naphthyridin-4-one (CID 10706862) is 7-ethoxy-2-phenyl-1H-1,8-naphthyridin-4-one.
What is the SMILES notation for 7-ethoxy-2-phenyl-1H-1,8-naphthyridin-4-one?
The canonical SMILES for 7-ethoxy-2-phenyl-1H-1,8-naphthyridin-4-one is CCOc1ccc2c(=O)cc(-c3ccccc3)[nH]c2n1.
What is the InChIKey of 7-ethoxy-2-phenyl-1H-1,8-naphthyridin-4-one?
The InChIKey is XFBOFPZZZNBLGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14N2O2/c1-2-20-15-9-8-12-14(19)10-13(17-16(12)18-15)11-6-4-3-5-7-11/h3-10H,2H2,1H3,(H,17,18,19).
What are the key properties of 7-ethoxy-2-phenyl-1H-1,8-naphthyridin-4-one?
7-ethoxy-2-phenyl-1H-1,8-naphthyridin-4-one has a molecular weight of 266.30 g/mol, XLogP of 2.99, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-ethoxy-2-phenyl-1H-1,8-naphthyridin-4-one is sourced from PubChem (CID 10706862), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).