7-(difluoromethoxy)-1H-1,5-naphthyridin-2-one

C9H6F2N2O2 — CID 130303543

IUPAC7-(difluoromethoxy)-1H-1,5-naphthyridin-2-one
SMILESO=c1ccc2ncc(OC(F)F)cc2[nH]1
InChIInChI=1S/C9H6F2N2O2/c10-9(11)15-5-3-7-6(12-4-5)1-2-8(14)13-7/h1-4,9H,(H,13,14)
InChIKeyPGBAUIVMSXYNNF-UHFFFAOYSA-N
MW212.16 g/mol
LogP1.52
Rot. Bonds2

About 7-(difluoromethoxy)-1H-1,5-naphthyridin-2-one

7-(difluoromethoxy)-1H-1,5-naphthyridin-2-one (PubChem CID 130303543) has the molecular formula C9H6F2N2O2 and a molecular weight of 212.16 g/mol. Its IUPAC name is 7-(difluoromethoxy)-1H-1,5-naphthyridin-2-one.

Molecular Properties

Compound Name7-(difluoromethoxy)-1H-1,5-naphthyridin-2-one
PubChem CID130303543
Molecular FormulaC9H6F2N2O2
Molecular Weight212.16 g/mol
Exact Mass212.04
IUPAC Name7-(difluoromethoxy)-1H-1,5-naphthyridin-2-one
SMILESO=c1ccc2ncc(OC(F)F)cc2[nH]1
InChIInChI=1S/C9H6F2N2O2/c10-9(11)15-5-3-7-6(12-4-5)1-2-8(14)13-7/h1-4,9H,(H,13,14)
InChIKeyPGBAUIVMSXYNNF-UHFFFAOYSA-N
XLogP1.52
TPSA54.98 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.16
LogP ≤ 51.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 7-(difluoromethoxy)-1H-1,5-naphthyridin-2-one?
The IUPAC name of 7-(difluoromethoxy)-1H-1,5-naphthyridin-2-one (CID 130303543) is 7-(difluoromethoxy)-1H-1,5-naphthyridin-2-one.
What is the SMILES notation for 7-(difluoromethoxy)-1H-1,5-naphthyridin-2-one?
The canonical SMILES for 7-(difluoromethoxy)-1H-1,5-naphthyridin-2-one is O=c1ccc2ncc(OC(F)F)cc2[nH]1.
What is the InChIKey of 7-(difluoromethoxy)-1H-1,5-naphthyridin-2-one?
The InChIKey is PGBAUIVMSXYNNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H6F2N2O2/c10-9(11)15-5-3-7-6(12-4-5)1-2-8(14)13-7/h1-4,9H,(H,13,14).
What are the key properties of 7-(difluoromethoxy)-1H-1,5-naphthyridin-2-one?
7-(difluoromethoxy)-1H-1,5-naphthyridin-2-one has a molecular weight of 212.16 g/mol, XLogP of 1.52, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(difluoromethoxy)-1H-1,5-naphthyridin-2-one is sourced from PubChem (CID 130303543), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).