1-(oxolan-3-yl)-1,6-naphthyridin-2-one

C12H12N2O2 — CID 154465710

IUPAC1-(oxolan-3-yl)-1,6-naphthyridin-2-one
SMILESO=c1ccc2cnccc2n1C1CCOC1
InChIInChI=1S/C12H12N2O2/c15-12-2-1-9-7-13-5-3-11(9)14(12)10-4-6-16-8-10/h1-3,5,7,10H,4,6,8H2
InChIKeyOUXLJVWWRJLTOI-UHFFFAOYSA-N
MW216.24 g/mol
LogP1.36
Rot. Bonds1

About 1-(oxolan-3-yl)-1,6-naphthyridin-2-one

1-(oxolan-3-yl)-1,6-naphthyridin-2-one (PubChem CID 154465710) has the molecular formula C12H12N2O2 and a molecular weight of 216.24 g/mol. Its IUPAC name is 1-(oxolan-3-yl)-1,6-naphthyridin-2-one.

Molecular Properties

Compound Name1-(oxolan-3-yl)-1,6-naphthyridin-2-one
PubChem CID154465710
Molecular FormulaC12H12N2O2
Molecular Weight216.24 g/mol
Exact Mass216.09
IUPAC Name1-(oxolan-3-yl)-1,6-naphthyridin-2-one
SMILESO=c1ccc2cnccc2n1C1CCOC1
InChIInChI=1S/C12H12N2O2/c15-12-2-1-9-7-13-5-3-11(9)14(12)10-4-6-16-8-10/h1-3,5,7,10H,4,6,8H2
InChIKeyOUXLJVWWRJLTOI-UHFFFAOYSA-N
XLogP1.36
TPSA44.12 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.24
LogP ≤ 51.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(oxolan-3-yl)-1,6-naphthyridin-2-one?
The IUPAC name of 1-(oxolan-3-yl)-1,6-naphthyridin-2-one (CID 154465710) is 1-(oxolan-3-yl)-1,6-naphthyridin-2-one.
What is the SMILES notation for 1-(oxolan-3-yl)-1,6-naphthyridin-2-one?
The canonical SMILES for 1-(oxolan-3-yl)-1,6-naphthyridin-2-one is O=c1ccc2cnccc2n1C1CCOC1.
What is the InChIKey of 1-(oxolan-3-yl)-1,6-naphthyridin-2-one?
The InChIKey is OUXLJVWWRJLTOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12N2O2/c15-12-2-1-9-7-13-5-3-11(9)14(12)10-4-6-16-8-10/h1-3,5,7,10H,4,6,8H2.
What are the key properties of 1-(oxolan-3-yl)-1,6-naphthyridin-2-one?
1-(oxolan-3-yl)-1,6-naphthyridin-2-one has a molecular weight of 216.24 g/mol, XLogP of 1.36, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(oxolan-3-yl)-1,6-naphthyridin-2-one is sourced from PubChem (CID 154465710), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).