1-ethylpyrido[2,3-d][1,3]oxazine-2,4-dione

C9H8N2O3 — CID 12793686

IUPAC1-ethylpyrido[2,3-d][1,3]oxazine-2,4-dione
SMILESCCn1c(=O)oc(=O)c2cccnc21
InChIInChI=1S/C9H8N2O3/c1-2-11-7-6(4-3-5-10-7)8(12)14-9(11)13/h3-5H,2H2,1H3
InChIKeyRUZUIBUUPXTHCY-UHFFFAOYSA-N
MW192.17 g/mol
LogP0.37
Rot. Bonds1

About 1-ethylpyrido[2,3-d][1,3]oxazine-2,4-dione

1-ethylpyrido[2,3-d][1,3]oxazine-2,4-dione (PubChem CID 12793686) has the molecular formula C9H8N2O3 and a molecular weight of 192.17 g/mol. Its IUPAC name is 1-ethylpyrido[2,3-d][1,3]oxazine-2,4-dione.

Molecular Properties

Compound Name1-ethylpyrido[2,3-d][1,3]oxazine-2,4-dione
PubChem CID12793686
Molecular FormulaC9H8N2O3
Molecular Weight192.17 g/mol
Exact Mass192.05
IUPAC Name1-ethylpyrido[2,3-d][1,3]oxazine-2,4-dione
SMILESCCn1c(=O)oc(=O)c2cccnc21
InChIInChI=1S/C9H8N2O3/c1-2-11-7-6(4-3-5-10-7)8(12)14-9(11)13/h3-5H,2H2,1H3
InChIKeyRUZUIBUUPXTHCY-UHFFFAOYSA-N
XLogP0.37
TPSA65.10 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.17
LogP ≤ 50.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-ethylpyrido[2,3-d][1,3]oxazine-2,4-dione?
The IUPAC name of 1-ethylpyrido[2,3-d][1,3]oxazine-2,4-dione (CID 12793686) is 1-ethylpyrido[2,3-d][1,3]oxazine-2,4-dione.
What is the SMILES notation for 1-ethylpyrido[2,3-d][1,3]oxazine-2,4-dione?
The canonical SMILES for 1-ethylpyrido[2,3-d][1,3]oxazine-2,4-dione is CCn1c(=O)oc(=O)c2cccnc21.
What is the InChIKey of 1-ethylpyrido[2,3-d][1,3]oxazine-2,4-dione?
The InChIKey is RUZUIBUUPXTHCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8N2O3/c1-2-11-7-6(4-3-5-10-7)8(12)14-9(11)13/h3-5H,2H2,1H3.
What are the key properties of 1-ethylpyrido[2,3-d][1,3]oxazine-2,4-dione?
1-ethylpyrido[2,3-d][1,3]oxazine-2,4-dione has a molecular weight of 192.17 g/mol, XLogP of 0.37, 1 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethylpyrido[2,3-d][1,3]oxazine-2,4-dione is sourced from PubChem (CID 12793686), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).