azane;1-hydroxy-3-methoxy-10-methylacridin-9-one

C15H16N2O3 — CID 87099944

IUPACazane;1-hydroxy-3-methoxy-10-methylacridin-9-one
SMILESCOc1cc(O)c2c(=O)c3ccccc3n(C)c2c1.N
InChIInChI=1S/C15H13NO3.H3N/c1-16-11-6-4-3-5-10(11)15(18)14-12(16)7-9(19-2)8-13(14)17;/h3-8,17H,1-2H3;1H3
InChIKeyUHWCLGBWZCLFLZ-UHFFFAOYSA-N
MW272.30 g/mol
LogP2.57
Rot. Bonds1

About azane;1-hydroxy-3-methoxy-10-methylacridin-9-one

azane;1-hydroxy-3-methoxy-10-methylacridin-9-one (PubChem CID 87099944) has the molecular formula C15H16N2O3 and a molecular weight of 272.30 g/mol. Its IUPAC name is azane;1-hydroxy-3-methoxy-10-methylacridin-9-one.

Molecular Properties

Compound Nameazane;1-hydroxy-3-methoxy-10-methylacridin-9-one
PubChem CID87099944
Molecular FormulaC15H16N2O3
Molecular Weight272.30 g/mol
Exact Mass272.12
IUPAC Nameazane;1-hydroxy-3-methoxy-10-methylacridin-9-one
SMILESCOc1cc(O)c2c(=O)c3ccccc3n(C)c2c1.N
InChIInChI=1S/C15H13NO3.H3N/c1-16-11-6-4-3-5-10(11)15(18)14-12(16)7-9(19-2)8-13(14)17;/h3-8,17H,1-2H3;1H3
InChIKeyUHWCLGBWZCLFLZ-UHFFFAOYSA-N
XLogP2.57
TPSA86.46 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.30
LogP ≤ 52.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of azane;1-hydroxy-3-methoxy-10-methylacridin-9-one?
The IUPAC name of azane;1-hydroxy-3-methoxy-10-methylacridin-9-one (CID 87099944) is azane;1-hydroxy-3-methoxy-10-methylacridin-9-one.
What is the SMILES notation for azane;1-hydroxy-3-methoxy-10-methylacridin-9-one?
The canonical SMILES for azane;1-hydroxy-3-methoxy-10-methylacridin-9-one is COc1cc(O)c2c(=O)c3ccccc3n(C)c2c1.N.
What is the InChIKey of azane;1-hydroxy-3-methoxy-10-methylacridin-9-one?
The InChIKey is UHWCLGBWZCLFLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13NO3.H3N/c1-16-11-6-4-3-5-10(11)15(18)14-12(16)7-9(19-2)8-13(14)17;/h3-8,17H,1-2H3;1H3.
What are the key properties of azane;1-hydroxy-3-methoxy-10-methylacridin-9-one?
azane;1-hydroxy-3-methoxy-10-methylacridin-9-one has a molecular weight of 272.30 g/mol, XLogP of 2.57, 1 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for azane;1-hydroxy-3-methoxy-10-methylacridin-9-one is sourced from PubChem (CID 87099944), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).