6-methyl-1H-pyrido[2,3-b][1,4]oxazin-2-one

C8H8N2O2 — CID 66936595

IUPAC6-methyl-1H-pyrido[2,3-b][1,4]oxazin-2-one
SMILESCc1ccc2c(n1)OCC(=O)N2
InChIInChI=1S/C8H8N2O2/c1-5-2-3-6-8(9-5)12-4-7(11)10-6/h2-3H,4H2,1H3,(H,10,11)
InChIKeyOBKUXCCMPCVLGB-UHFFFAOYSA-N
MW164.16 g/mol
LogP0.72
Rot. Bonds

About 6-methyl-1H-pyrido[2,3-b][1,4]oxazin-2-one

6-methyl-1H-pyrido[2,3-b][1,4]oxazin-2-one (PubChem CID 66936595) has the molecular formula C8H8N2O2 and a molecular weight of 164.16 g/mol. Its IUPAC name is 6-methyl-1H-pyrido[2,3-b][1,4]oxazin-2-one.

Molecular Properties

Compound Name6-methyl-1H-pyrido[2,3-b][1,4]oxazin-2-one
PubChem CID66936595
Molecular FormulaC8H8N2O2
Molecular Weight164.16 g/mol
Exact Mass164.06
IUPAC Name6-methyl-1H-pyrido[2,3-b][1,4]oxazin-2-one
SMILESCc1ccc2c(n1)OCC(=O)N2
InChIInChI=1S/C8H8N2O2/c1-5-2-3-6-8(9-5)12-4-7(11)10-6/h2-3H,4H2,1H3,(H,10,11)
InChIKeyOBKUXCCMPCVLGB-UHFFFAOYSA-N
XLogP0.72
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.16
LogP ≤ 50.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-methyl-1H-pyrido[2,3-b][1,4]oxazin-2-one?
The IUPAC name of 6-methyl-1H-pyrido[2,3-b][1,4]oxazin-2-one (CID 66936595) is 6-methyl-1H-pyrido[2,3-b][1,4]oxazin-2-one.
What is the SMILES notation for 6-methyl-1H-pyrido[2,3-b][1,4]oxazin-2-one?
The canonical SMILES for 6-methyl-1H-pyrido[2,3-b][1,4]oxazin-2-one is Cc1ccc2c(n1)OCC(=O)N2.
What is the InChIKey of 6-methyl-1H-pyrido[2,3-b][1,4]oxazin-2-one?
The InChIKey is OBKUXCCMPCVLGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8N2O2/c1-5-2-3-6-8(9-5)12-4-7(11)10-6/h2-3H,4H2,1H3,(H,10,11).
What are the key properties of 6-methyl-1H-pyrido[2,3-b][1,4]oxazin-2-one?
6-methyl-1H-pyrido[2,3-b][1,4]oxazin-2-one has a molecular weight of 164.16 g/mol, XLogP of 0.72, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-1H-pyrido[2,3-b][1,4]oxazin-2-one is sourced from PubChem (CID 66936595), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).