acridine-1,2-dicarboxamide

C15H11N3O2 — CID 154155519

IUPACacridine-1,2-dicarboxamide
SMILESNC(=O)c1ccc2nc3ccccc3cc2c1C(N)=O
InChIInChI=1S/C15H11N3O2/c16-14(19)9-5-6-12-10(13(9)15(17)20)7-8-3-1-2-4-11(8)18-12/h1-7H,(H2,16,19)(H2,17,20)
InChIKeyUAQYFNAOQLUHOQ-UHFFFAOYSA-N
MW265.27 g/mol
LogP1.59
Rot. Bonds2

About acridine-1,2-dicarboxamide

acridine-1,2-dicarboxamide (PubChem CID 154155519) has the molecular formula C15H11N3O2 and a molecular weight of 265.27 g/mol. Its IUPAC name is acridine-1,2-dicarboxamide.

Molecular Properties

Compound Nameacridine-1,2-dicarboxamide
PubChem CID154155519
Molecular FormulaC15H11N3O2
Molecular Weight265.27 g/mol
Exact Mass265.09
IUPAC Nameacridine-1,2-dicarboxamide
SMILESNC(=O)c1ccc2nc3ccccc3cc2c1C(N)=O
InChIInChI=1S/C15H11N3O2/c16-14(19)9-5-6-12-10(13(9)15(17)20)7-8-3-1-2-4-11(8)18-12/h1-7H,(H2,16,19)(H2,17,20)
InChIKeyUAQYFNAOQLUHOQ-UHFFFAOYSA-N
XLogP1.59
TPSA99.07 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.27
LogP ≤ 51.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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 acridine-1,2-dicarboxamide?
The IUPAC name of acridine-1,2-dicarboxamide (CID 154155519) is acridine-1,2-dicarboxamide.
What is the SMILES notation for acridine-1,2-dicarboxamide?
The canonical SMILES for acridine-1,2-dicarboxamide is NC(=O)c1ccc2nc3ccccc3cc2c1C(N)=O.
What is the InChIKey of acridine-1,2-dicarboxamide?
The InChIKey is UAQYFNAOQLUHOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11N3O2/c16-14(19)9-5-6-12-10(13(9)15(17)20)7-8-3-1-2-4-11(8)18-12/h1-7H,(H2,16,19)(H2,17,20).
What are the key properties of acridine-1,2-dicarboxamide?
acridine-1,2-dicarboxamide has a molecular weight of 265.27 g/mol, XLogP of 1.59, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for acridine-1,2-dicarboxamide is sourced from PubChem (CID 154155519), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).