7-amino-1H-pyrido[2,3-b][1,4]oxazin-2-one

C7H7N3O2 — CID 58653175

IUPAC7-amino-1H-pyrido[2,3-b][1,4]oxazin-2-one
SMILESNc1cnc2c(c1)NC(=O)CO2
InChIInChI=1S/C7H7N3O2/c8-4-1-5-7(9-2-4)12-3-6(11)10-5/h1-2H,3,8H2,(H,10,11)
InChIKeyRZIIARDHNQEMGR-UHFFFAOYSA-N
MW165.15 g/mol
LogP-0.01
Rot. Bonds

About 7-amino-1H-pyrido[2,3-b][1,4]oxazin-2-one

7-amino-1H-pyrido[2,3-b][1,4]oxazin-2-one (PubChem CID 58653175) has the molecular formula C7H7N3O2 and a molecular weight of 165.15 g/mol. Its IUPAC name is 7-amino-1H-pyrido[2,3-b][1,4]oxazin-2-one.

Molecular Properties

Compound Name7-amino-1H-pyrido[2,3-b][1,4]oxazin-2-one
PubChem CID58653175
Molecular FormulaC7H7N3O2
Molecular Weight165.15 g/mol
Exact Mass165.05
IUPAC Name7-amino-1H-pyrido[2,3-b][1,4]oxazin-2-one
SMILESNc1cnc2c(c1)NC(=O)CO2
InChIInChI=1S/C7H7N3O2/c8-4-1-5-7(9-2-4)12-3-6(11)10-5/h1-2H,3,8H2,(H,10,11)
InChIKeyRZIIARDHNQEMGR-UHFFFAOYSA-N
XLogP-0.01
TPSA77.24 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.15
LogP ≤ 5-0.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 7-amino-1H-pyrido[2,3-b][1,4]oxazin-2-one?
The IUPAC name of 7-amino-1H-pyrido[2,3-b][1,4]oxazin-2-one (CID 58653175) is 7-amino-1H-pyrido[2,3-b][1,4]oxazin-2-one.
What is the SMILES notation for 7-amino-1H-pyrido[2,3-b][1,4]oxazin-2-one?
The canonical SMILES for 7-amino-1H-pyrido[2,3-b][1,4]oxazin-2-one is Nc1cnc2c(c1)NC(=O)CO2.
What is the InChIKey of 7-amino-1H-pyrido[2,3-b][1,4]oxazin-2-one?
The InChIKey is RZIIARDHNQEMGR-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7N3O2/c8-4-1-5-7(9-2-4)12-3-6(11)10-5/h1-2H,3,8H2,(H,10,11).
What are the key properties of 7-amino-1H-pyrido[2,3-b][1,4]oxazin-2-one?
7-amino-1H-pyrido[2,3-b][1,4]oxazin-2-one has a molecular weight of 165.15 g/mol, XLogP of -0.01, 0 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-amino-1H-pyrido[2,3-b][1,4]oxazin-2-one is sourced from PubChem (CID 58653175), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).