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

C16H10N2O2 — CID 11010774

IUPAC11-methylpyrido[3,2-a]phenoxazin-5-one
SMILESCc1cccc2oc3cc(=O)c4ncccc4c-3nc12
InChIInChI=1S/C16H10N2O2/c1-9-4-2-6-12-14(9)18-16-10-5-3-7-17-15(10)11(19)8-13(16)20-12/h2-8H,1H3
InChIKeyMSMRCJQNVPASJT-UHFFFAOYSA-N
MW262.27 g/mol
LogP3.15
Rot. Bonds

About 11-methylpyrido[3,2-a]phenoxazin-5-one

11-methylpyrido[3,2-a]phenoxazin-5-one (PubChem CID 11010774) has the molecular formula C16H10N2O2 and a molecular weight of 262.27 g/mol. Its IUPAC name is 11-methylpyrido[3,2-a]phenoxazin-5-one.

Molecular Properties

Compound Name11-methylpyrido[3,2-a]phenoxazin-5-one
PubChem CID11010774
Molecular FormulaC16H10N2O2
Molecular Weight262.27 g/mol
Exact Mass262.07
IUPAC Name11-methylpyrido[3,2-a]phenoxazin-5-one
SMILESCc1cccc2oc3cc(=O)c4ncccc4c-3nc12
InChIInChI=1S/C16H10N2O2/c1-9-4-2-6-12-14(9)18-16-10-5-3-7-17-15(10)11(19)8-13(16)20-12/h2-8H,1H3
InChIKeyMSMRCJQNVPASJT-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 11-methylpyrido[3,2-a]phenoxazin-5-one?
The IUPAC name of 11-methylpyrido[3,2-a]phenoxazin-5-one (CID 11010774) is 11-methylpyrido[3,2-a]phenoxazin-5-one.
What is the SMILES notation for 11-methylpyrido[3,2-a]phenoxazin-5-one?
The canonical SMILES for 11-methylpyrido[3,2-a]phenoxazin-5-one is Cc1cccc2oc3cc(=O)c4ncccc4c-3nc12.
What is the InChIKey of 11-methylpyrido[3,2-a]phenoxazin-5-one?
The InChIKey is MSMRCJQNVPASJT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H10N2O2/c1-9-4-2-6-12-14(9)18-16-10-5-3-7-17-15(10)11(19)8-13(16)20-12/h2-8H,1H3.
What are the key properties of 11-methylpyrido[3,2-a]phenoxazin-5-one?
11-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 11-methylpyrido[3,2-a]phenoxazin-5-one is sourced from PubChem (CID 11010774), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).