2,4-dimethylphenazin-1-ol;ethane

C18H24N2O — CID 145233565

IUPAC2,4-dimethylphenazin-1-ol;ethane
SMILESCC.CC.Cc1cc(C)c2nc3ccccc3nc2c1O
InChIInChI=1S/C14H12N2O.2C2H6/c1-8-7-9(2)14(17)13-12(8)15-10-5-3-4-6-11(10)16-13;2*1-2/h3-7,17H,1-2H3;2*1-2H3
InChIKeyISTACTKENDACCB-UHFFFAOYSA-N
MW284.40 g/mol
LogP5.16
Rot. Bonds

About 2,4-dimethylphenazin-1-ol;ethane

2,4-dimethylphenazin-1-ol;ethane (PubChem CID 145233565) has the molecular formula C18H24N2O and a molecular weight of 284.40 g/mol. Its IUPAC name is 2,4-dimethylphenazin-1-ol;ethane.

Molecular Properties

Compound Name2,4-dimethylphenazin-1-ol;ethane
PubChem CID145233565
Molecular FormulaC18H24N2O
Molecular Weight284.40 g/mol
Exact Mass284.19
IUPAC Name2,4-dimethylphenazin-1-ol;ethane
SMILESCC.CC.Cc1cc(C)c2nc3ccccc3nc2c1O
InChIInChI=1S/C14H12N2O.2C2H6/c1-8-7-9(2)14(17)13-12(8)15-10-5-3-4-6-11(10)16-13;2*1-2/h3-7,17H,1-2H3;2*1-2H3
InChIKeyISTACTKENDACCB-UHFFFAOYSA-N
XLogP5.16
TPSA46.01 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms21
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500284.40
LogP ≤ 55.16
H-Bond Donors ≤ 51
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 2,4-dimethylphenazin-1-ol;ethane?
The IUPAC name of 2,4-dimethylphenazin-1-ol;ethane (CID 145233565) is 2,4-dimethylphenazin-1-ol;ethane.
What is the SMILES notation for 2,4-dimethylphenazin-1-ol;ethane?
The canonical SMILES for 2,4-dimethylphenazin-1-ol;ethane is CC.CC.Cc1cc(C)c2nc3ccccc3nc2c1O.
What is the InChIKey of 2,4-dimethylphenazin-1-ol;ethane?
The InChIKey is ISTACTKENDACCB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12N2O.2C2H6/c1-8-7-9(2)14(17)13-12(8)15-10-5-3-4-6-11(10)16-13;2*1-2/h3-7,17H,1-2H3;2*1-2H3.
What are the key properties of 2,4-dimethylphenazin-1-ol;ethane?
2,4-dimethylphenazin-1-ol;ethane has a molecular weight of 284.40 g/mol, XLogP of 5.16, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dimethylphenazin-1-ol;ethane is sourced from PubChem (CID 145233565), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).