2-naphthalen-1-yl-1,2-dihydropyrido[3,2-d][1,3]oxazin-4-one

C17H12N2O2 — CID 121005519

IUPAC2-naphthalen-1-yl-1,2-dihydropyrido[3,2-d][1,3]oxazin-4-one
SMILESO=C1OC(c2cccc3ccccc23)Nc2cccnc21
InChIInChI=1S/C17H12N2O2/c20-17-15-14(9-4-10-18-15)19-16(21-17)13-8-3-6-11-5-1-2-7-12(11)13/h1-10,16,19H
InChIKeyZXRNQTGEXDAOIU-UHFFFAOYSA-N
MW276.30 g/mol
LogP3.52
Rot. Bonds1

About 2-naphthalen-1-yl-1,2-dihydropyrido[3,2-d][1,3]oxazin-4-one

2-naphthalen-1-yl-1,2-dihydropyrido[3,2-d][1,3]oxazin-4-one (PubChem CID 121005519) has the molecular formula C17H12N2O2 and a molecular weight of 276.30 g/mol. Its IUPAC name is 2-naphthalen-1-yl-1,2-dihydropyrido[3,2-d][1,3]oxazin-4-one.

Molecular Properties

Compound Name2-naphthalen-1-yl-1,2-dihydropyrido[3,2-d][1,3]oxazin-4-one
PubChem CID121005519
Molecular FormulaC17H12N2O2
Molecular Weight276.30 g/mol
Exact Mass276.09
IUPAC Name2-naphthalen-1-yl-1,2-dihydropyrido[3,2-d][1,3]oxazin-4-one
SMILESO=C1OC(c2cccc3ccccc23)Nc2cccnc21
InChIInChI=1S/C17H12N2O2/c20-17-15-14(9-4-10-18-15)19-16(21-17)13-8-3-6-11-5-1-2-7-12(11)13/h1-10,16,19H
InChIKeyZXRNQTGEXDAOIU-UHFFFAOYSA-N
XLogP3.52
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.30
LogP ≤ 53.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-naphthalen-1-yl-1,2-dihydropyrido[3,2-d][1,3]oxazin-4-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-naphthalen-1-yl-1,2-dihydropyrido[3,2-d][1,3]oxazin-4-one?
The IUPAC name of 2-naphthalen-1-yl-1,2-dihydropyrido[3,2-d][1,3]oxazin-4-one (CID 121005519) is 2-naphthalen-1-yl-1,2-dihydropyrido[3,2-d][1,3]oxazin-4-one.
What is the SMILES notation for 2-naphthalen-1-yl-1,2-dihydropyrido[3,2-d][1,3]oxazin-4-one?
The canonical SMILES for 2-naphthalen-1-yl-1,2-dihydropyrido[3,2-d][1,3]oxazin-4-one is O=C1OC(c2cccc3ccccc23)Nc2cccnc21.
What is the InChIKey of 2-naphthalen-1-yl-1,2-dihydropyrido[3,2-d][1,3]oxazin-4-one?
The InChIKey is ZXRNQTGEXDAOIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H12N2O2/c20-17-15-14(9-4-10-18-15)19-16(21-17)13-8-3-6-11-5-1-2-7-12(11)13/h1-10,16,19H.
What are the key properties of 2-naphthalen-1-yl-1,2-dihydropyrido[3,2-d][1,3]oxazin-4-one?
2-naphthalen-1-yl-1,2-dihydropyrido[3,2-d][1,3]oxazin-4-one has a molecular weight of 276.30 g/mol, XLogP of 3.52, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-naphthalen-1-yl-1,2-dihydropyrido[3,2-d][1,3]oxazin-4-one is sourced from PubChem (CID 121005519), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).