9-methylpyrido[3,2-a]phenoxazin-5-one

C16H10N2O2 — CID 10923332

IUPAC9-methylpyrido[3,2-a]phenoxazin-5-one
SMILESCc1ccc2nc3c4cccnc4c(=O)cc-3oc2c1
InChIInChI=1S/C16H10N2O2/c1-9-4-5-11-13(7-9)20-14-8-12(19)15-10(16(14)18-11)3-2-6-17-15/h2-8H,1H3
InChIKeySQFVGZXBAUOTRW-UHFFFAOYSA-N
MW262.27 g/mol
LogP3.15
Rot. Bonds

About 9-methylpyrido[3,2-a]phenoxazin-5-one

9-methylpyrido[3,2-a]phenoxazin-5-one (PubChem CID 10923332) has the molecular formula C16H10N2O2 and a molecular weight of 262.27 g/mol. Its IUPAC name is 9-methylpyrido[3,2-a]phenoxazin-5-one.

Molecular Properties

Compound Name9-methylpyrido[3,2-a]phenoxazin-5-one
PubChem CID10923332
Molecular FormulaC16H10N2O2
Molecular Weight262.27 g/mol
Exact Mass262.07
IUPAC Name9-methylpyrido[3,2-a]phenoxazin-5-one
SMILESCc1ccc2nc3c4cccnc4c(=O)cc-3oc2c1
InChIInChI=1S/C16H10N2O2/c1-9-4-5-11-13(7-9)20-14-8-12(19)15-10(16(14)18-11)3-2-6-17-15/h2-8H,1H3
InChIKeySQFVGZXBAUOTRW-UHFFFAOYSA-N
XLogP3.15
TPSA55.99 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.27
LogP ≤ 53.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 9-methylpyrido[3,2-a]phenoxazin-5-one?
The IUPAC name of 9-methylpyrido[3,2-a]phenoxazin-5-one (CID 10923332) is 9-methylpyrido[3,2-a]phenoxazin-5-one.
What is the SMILES notation for 9-methylpyrido[3,2-a]phenoxazin-5-one?
The canonical SMILES for 9-methylpyrido[3,2-a]phenoxazin-5-one is Cc1ccc2nc3c4cccnc4c(=O)cc-3oc2c1.
What is the InChIKey of 9-methylpyrido[3,2-a]phenoxazin-5-one?
The InChIKey is SQFVGZXBAUOTRW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H10N2O2/c1-9-4-5-11-13(7-9)20-14-8-12(19)15-10(16(14)18-11)3-2-6-17-15/h2-8H,1H3.
What are the key properties of 9-methylpyrido[3,2-a]phenoxazin-5-one?
9-methylpyrido[3,2-a]phenoxazin-5-one has a molecular weight of 262.27 g/mol, XLogP of 3.15, 0 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 9-methylpyrido[3,2-a]phenoxazin-5-one is sourced from PubChem (CID 10923332), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).