6-ethoxy-2-ethyl-1H-1,5-naphthyridin-4-one

C12H14N2O2 — CID 19890809

IUPAC6-ethoxy-2-ethyl-1H-1,5-naphthyridin-4-one
SMILESCCOc1ccc2[nH]c(CC)cc(=O)c2n1
InChIInChI=1S/C12H14N2O2/c1-3-8-7-10(15)12-9(13-8)5-6-11(14-12)16-4-2/h5-7H,3-4H2,1-2H3,(H,13,15)
InChIKeyBHVKMBGIHKFECK-UHFFFAOYSA-N
MW218.26 g/mol
LogP1.88
Rot. Bonds3

About 6-ethoxy-2-ethyl-1H-1,5-naphthyridin-4-one

6-ethoxy-2-ethyl-1H-1,5-naphthyridin-4-one (PubChem CID 19890809) has the molecular formula C12H14N2O2 and a molecular weight of 218.26 g/mol. Its IUPAC name is 6-ethoxy-2-ethyl-1H-1,5-naphthyridin-4-one.

Molecular Properties

Compound Name6-ethoxy-2-ethyl-1H-1,5-naphthyridin-4-one
PubChem CID19890809
Molecular FormulaC12H14N2O2
Molecular Weight218.26 g/mol
Exact Mass218.11
IUPAC Name6-ethoxy-2-ethyl-1H-1,5-naphthyridin-4-one
SMILESCCOc1ccc2[nH]c(CC)cc(=O)c2n1
InChIInChI=1S/C12H14N2O2/c1-3-8-7-10(15)12-9(13-8)5-6-11(14-12)16-4-2/h5-7H,3-4H2,1-2H3,(H,13,15)
InChIKeyBHVKMBGIHKFECK-UHFFFAOYSA-N
XLogP1.88
TPSA54.98 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.26
LogP ≤ 51.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-ethoxy-2-ethyl-1H-1,5-naphthyridin-4-one?
The IUPAC name of 6-ethoxy-2-ethyl-1H-1,5-naphthyridin-4-one (CID 19890809) is 6-ethoxy-2-ethyl-1H-1,5-naphthyridin-4-one.
What is the SMILES notation for 6-ethoxy-2-ethyl-1H-1,5-naphthyridin-4-one?
The canonical SMILES for 6-ethoxy-2-ethyl-1H-1,5-naphthyridin-4-one is CCOc1ccc2[nH]c(CC)cc(=O)c2n1.
What is the InChIKey of 6-ethoxy-2-ethyl-1H-1,5-naphthyridin-4-one?
The InChIKey is BHVKMBGIHKFECK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N2O2/c1-3-8-7-10(15)12-9(13-8)5-6-11(14-12)16-4-2/h5-7H,3-4H2,1-2H3,(H,13,15).
What are the key properties of 6-ethoxy-2-ethyl-1H-1,5-naphthyridin-4-one?
6-ethoxy-2-ethyl-1H-1,5-naphthyridin-4-one has a molecular weight of 218.26 g/mol, XLogP of 1.88, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethoxy-2-ethyl-1H-1,5-naphthyridin-4-one is sourced from PubChem (CID 19890809), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).