2-oxopyrido[2,3-b][1,4]oxazine-1-carboxamide

C8H7N3O3 — CID 173185596

IUPAC2-oxopyrido[2,3-b][1,4]oxazine-1-carboxamide
SMILESNC(=O)N1C(=O)COc2ncccc21
InChIInChI=1S/C8H7N3O3/c9-8(13)11-5-2-1-3-10-7(5)14-4-6(11)12/h1-3H,4H2,(H2,9,13)
InChIKeyXCBFNDABLSWKBN-UHFFFAOYSA-N
MW193.16 g/mol
LogP-0.11
Rot. Bonds

About 2-oxopyrido[2,3-b][1,4]oxazine-1-carboxamide

2-oxopyrido[2,3-b][1,4]oxazine-1-carboxamide (PubChem CID 173185596) has the molecular formula C8H7N3O3 and a molecular weight of 193.16 g/mol. Its IUPAC name is 2-oxopyrido[2,3-b][1,4]oxazine-1-carboxamide.

Molecular Properties

Compound Name2-oxopyrido[2,3-b][1,4]oxazine-1-carboxamide
PubChem CID173185596
Molecular FormulaC8H7N3O3
Molecular Weight193.16 g/mol
Exact Mass193.05
IUPAC Name2-oxopyrido[2,3-b][1,4]oxazine-1-carboxamide
SMILESNC(=O)N1C(=O)COc2ncccc21
InChIInChI=1S/C8H7N3O3/c9-8(13)11-5-2-1-3-10-7(5)14-4-6(11)12/h1-3H,4H2,(H2,9,13)
InChIKeyXCBFNDABLSWKBN-UHFFFAOYSA-N
XLogP-0.11
TPSA85.52 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.16
LogP ≤ 5-0.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-oxopyrido[2,3-b][1,4]oxazine-1-carboxamide?
The IUPAC name of 2-oxopyrido[2,3-b][1,4]oxazine-1-carboxamide (CID 173185596) is 2-oxopyrido[2,3-b][1,4]oxazine-1-carboxamide.
What is the SMILES notation for 2-oxopyrido[2,3-b][1,4]oxazine-1-carboxamide?
The canonical SMILES for 2-oxopyrido[2,3-b][1,4]oxazine-1-carboxamide is NC(=O)N1C(=O)COc2ncccc21.
What is the InChIKey of 2-oxopyrido[2,3-b][1,4]oxazine-1-carboxamide?
The InChIKey is XCBFNDABLSWKBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H7N3O3/c9-8(13)11-5-2-1-3-10-7(5)14-4-6(11)12/h1-3H,4H2,(H2,9,13).
What are the key properties of 2-oxopyrido[2,3-b][1,4]oxazine-1-carboxamide?
2-oxopyrido[2,3-b][1,4]oxazine-1-carboxamide has a molecular weight of 193.16 g/mol, XLogP of -0.11, 0 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-oxopyrido[2,3-b][1,4]oxazine-1-carboxamide is sourced from PubChem (CID 173185596), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).