7-(5-fluoro-3-pyridinyl)-2,3-dihydropyrido[3,2-b][1,4]oxazine-4-carboxamide

C13H11FN4O2 — CID 86305716

IUPAC7-(5-fluoro-3-pyridinyl)-2,3-dihydropyrido[3,2-b][1,4]oxazine-4-carboxamide
SMILESNC(=O)N1CCOc2cc(-c3cncc(F)c3)cnc21
InChIInChI=1S/C13H11FN4O2/c14-10-3-8(5-16-7-10)9-4-11-12(17-6-9)18(13(15)19)1-2-20-11/h3-7H,1-2H2,(H2,15,19)
InChIKeyMWKGYIZRRONYGC-UHFFFAOYSA-N
MW274.26 g/mol
LogP1.56
Rot. Bonds1

About 7-(5-fluoro-3-pyridinyl)-2,3-dihydropyrido[3,2-b][1,4]oxazine-4-carboxamide

7-(5-fluoro-3-pyridinyl)-2,3-dihydropyrido[3,2-b][1,4]oxazine-4-carboxamide (PubChem CID 86305716) has the molecular formula C13H11FN4O2 and a molecular weight of 274.26 g/mol. Its IUPAC name is 7-(5-fluoro-3-pyridinyl)-2,3-dihydropyrido[3,2-b][1,4]oxazine-4-carboxamide.

Molecular Properties

Compound Name7-(5-fluoro-3-pyridinyl)-2,3-dihydropyrido[3,2-b][1,4]oxazine-4-carboxamide
PubChem CID86305716
Molecular FormulaC13H11FN4O2
Molecular Weight274.26 g/mol
Exact Mass274.09
IUPAC Name7-(5-fluoro-3-pyridinyl)-2,3-dihydropyrido[3,2-b][1,4]oxazine-4-carboxamide
SMILESNC(=O)N1CCOc2cc(-c3cncc(F)c3)cnc21
InChIInChI=1S/C13H11FN4O2/c14-10-3-8(5-16-7-10)9-4-11-12(17-6-9)18(13(15)19)1-2-20-11/h3-7H,1-2H2,(H2,15,19)
InChIKeyMWKGYIZRRONYGC-UHFFFAOYSA-N
XLogP1.56
TPSA81.34 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.26
LogP ≤ 51.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 7-(5-fluoro-3-pyridinyl)-2,3-dihydropyrido[3,2-b][1,4]oxazine-4-carboxamide?
The IUPAC name of 7-(5-fluoro-3-pyridinyl)-2,3-dihydropyrido[3,2-b][1,4]oxazine-4-carboxamide (CID 86305716) is 7-(5-fluoro-3-pyridinyl)-2,3-dihydropyrido[3,2-b][1,4]oxazine-4-carboxamide.
What is the SMILES notation for 7-(5-fluoro-3-pyridinyl)-2,3-dihydropyrido[3,2-b][1,4]oxazine-4-carboxamide?
The canonical SMILES for 7-(5-fluoro-3-pyridinyl)-2,3-dihydropyrido[3,2-b][1,4]oxazine-4-carboxamide is NC(=O)N1CCOc2cc(-c3cncc(F)c3)cnc21.
What is the InChIKey of 7-(5-fluoro-3-pyridinyl)-2,3-dihydropyrido[3,2-b][1,4]oxazine-4-carboxamide?
The InChIKey is MWKGYIZRRONYGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11FN4O2/c14-10-3-8(5-16-7-10)9-4-11-12(17-6-9)18(13(15)19)1-2-20-11/h3-7H,1-2H2,(H2,15,19).
What are the key properties of 7-(5-fluoro-3-pyridinyl)-2,3-dihydropyrido[3,2-b][1,4]oxazine-4-carboxamide?
7-(5-fluoro-3-pyridinyl)-2,3-dihydropyrido[3,2-b][1,4]oxazine-4-carboxamide has a molecular weight of 274.26 g/mol, XLogP of 1.56, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(5-fluoro-3-pyridinyl)-2,3-dihydropyrido[3,2-b][1,4]oxazine-4-carboxamide is sourced from PubChem (CID 86305716), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).