9,10-dihydroanthra[2,3-g]quinoxaline

C20H14N2 — CID 130290511

IUPAC9,10-dihydroanthra[2,3-g]quinoxaline
SMILESC1=c2cc3cc4cc5nccnc5cc4cc3cc2=CCC1
InChIInChI=1S/C20H14N2/c1-2-4-14-8-16-10-18-12-20-19(21-5-6-22-20)11-17(18)9-15(16)7-13(14)3-1/h3-12H,1-2H2
InChIKeyJSSLKULEUZANOJ-UHFFFAOYSA-N
MW282.35 g/mol
LogP3.29
Rot. Bonds

About 9,10-dihydroanthra[2,3-g]quinoxaline

9,10-dihydroanthra[2,3-g]quinoxaline (PubChem CID 130290511) has the molecular formula C20H14N2 and a molecular weight of 282.35 g/mol. Its IUPAC name is 9,10-dihydroanthra[2,3-g]quinoxaline.

Molecular Properties

Compound Name9,10-dihydroanthra[2,3-g]quinoxaline
PubChem CID130290511
Molecular FormulaC20H14N2
Molecular Weight282.35 g/mol
Exact Mass282.12
IUPAC Name9,10-dihydroanthra[2,3-g]quinoxaline
SMILESC1=c2cc3cc4cc5nccnc5cc4cc3cc2=CCC1
InChIInChI=1S/C20H14N2/c1-2-4-14-8-16-10-18-12-20-19(21-5-6-22-20)11-17(18)9-15(16)7-13(14)3-1/h3-12H,1-2H2
InChIKeyJSSLKULEUZANOJ-UHFFFAOYSA-N
XLogP3.29
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.35
LogP ≤ 53.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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 9,10-dihydroanthra[2,3-g]quinoxaline?
The IUPAC name of 9,10-dihydroanthra[2,3-g]quinoxaline (CID 130290511) is 9,10-dihydroanthra[2,3-g]quinoxaline.
What is the SMILES notation for 9,10-dihydroanthra[2,3-g]quinoxaline?
The canonical SMILES for 9,10-dihydroanthra[2,3-g]quinoxaline is C1=c2cc3cc4cc5nccnc5cc4cc3cc2=CCC1.
What is the InChIKey of 9,10-dihydroanthra[2,3-g]quinoxaline?
The InChIKey is JSSLKULEUZANOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H14N2/c1-2-4-14-8-16-10-18-12-20-19(21-5-6-22-20)11-17(18)9-15(16)7-13(14)3-1/h3-12H,1-2H2.
What are the key properties of 9,10-dihydroanthra[2,3-g]quinoxaline?
9,10-dihydroanthra[2,3-g]quinoxaline has a molecular weight of 282.35 g/mol, XLogP of 3.29, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9,10-dihydroanthra[2,3-g]quinoxaline is sourced from PubChem (CID 130290511), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).