8,9-dihydrobenzo[b]phenazine

C16H12N2 — CID 166920687

IUPAC8,9-dihydrobenzo[b]phenazine
SMILESC1=c2cc3nc4ccccc4nc3cc2=CCC1
InChIInChI=1S/C16H12N2/c1-2-6-12-10-16-15(9-11(12)5-1)17-13-7-3-4-8-14(13)18-16/h3-10H,1-2H2
InChIKeyIUXIODINBOXCJO-UHFFFAOYSA-N
MW232.29 g/mol
LogP2.14
Rot. Bonds

About 8,9-dihydrobenzo[b]phenazine

8,9-dihydrobenzo[b]phenazine (PubChem CID 166920687) has the molecular formula C16H12N2 and a molecular weight of 232.29 g/mol. Its IUPAC name is 8,9-dihydrobenzo[b]phenazine.

Molecular Properties

Compound Name8,9-dihydrobenzo[b]phenazine
PubChem CID166920687
Molecular FormulaC16H12N2
Molecular Weight232.29 g/mol
Exact Mass232.10
IUPAC Name8,9-dihydrobenzo[b]phenazine
SMILESC1=c2cc3nc4ccccc4nc3cc2=CCC1
InChIInChI=1S/C16H12N2/c1-2-6-12-10-16-15(9-11(12)5-1)17-13-7-3-4-8-14(13)18-16/h3-10H,1-2H2
InChIKeyIUXIODINBOXCJO-UHFFFAOYSA-N
XLogP2.14
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.29
LogP ≤ 52.14
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 8,9-dihydrobenzo[b]phenazine?
The IUPAC name of 8,9-dihydrobenzo[b]phenazine (CID 166920687) is 8,9-dihydrobenzo[b]phenazine.
What is the SMILES notation for 8,9-dihydrobenzo[b]phenazine?
The canonical SMILES for 8,9-dihydrobenzo[b]phenazine is C1=c2cc3nc4ccccc4nc3cc2=CCC1.
What is the InChIKey of 8,9-dihydrobenzo[b]phenazine?
The InChIKey is IUXIODINBOXCJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H12N2/c1-2-6-12-10-16-15(9-11(12)5-1)17-13-7-3-4-8-14(13)18-16/h3-10H,1-2H2.
What are the key properties of 8,9-dihydrobenzo[b]phenazine?
8,9-dihydrobenzo[b]phenazine has a molecular weight of 232.29 g/mol, XLogP of 2.14, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8,9-dihydrobenzo[b]phenazine is sourced from PubChem (CID 166920687), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).