1,10a-dihydrophenazine

C12H10N2 — CID 77155903

IUPAC1,10a-dihydrophenazine
SMILESC1=CCC2N=c3ccccc3=NC2=C1
InChIInChI=1S/C12H10N2/c1-2-6-10-9(5-1)13-11-7-3-4-8-12(11)14-10/h1-7,12H,8H2
InChIKeyJOIFFRGUCRHWJF-UHFFFAOYSA-N
MW182.23 g/mol
LogP1.15
Rot. Bonds

About 1,10a-dihydrophenazine

1,10a-dihydrophenazine (PubChem CID 77155903) has the molecular formula C12H10N2 and a molecular weight of 182.23 g/mol. Its IUPAC name is 1,10a-dihydrophenazine.

Molecular Properties

Compound Name1,10a-dihydrophenazine
PubChem CID77155903
Molecular FormulaC12H10N2
Molecular Weight182.23 g/mol
Exact Mass182.08
IUPAC Name1,10a-dihydrophenazine
SMILESC1=CCC2N=c3ccccc3=NC2=C1
InChIInChI=1S/C12H10N2/c1-2-6-10-9(5-1)13-11-7-3-4-8-12(11)14-10/h1-7,12H,8H2
InChIKeyJOIFFRGUCRHWJF-UHFFFAOYSA-N
XLogP1.15
TPSA24.72 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.23
LogP ≤ 51.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1,10a-dihydrophenazine?
The IUPAC name of 1,10a-dihydrophenazine (CID 77155903) is 1,10a-dihydrophenazine.
What is the SMILES notation for 1,10a-dihydrophenazine?
The canonical SMILES for 1,10a-dihydrophenazine is C1=CCC2N=c3ccccc3=NC2=C1.
What is the InChIKey of 1,10a-dihydrophenazine?
The InChIKey is JOIFFRGUCRHWJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10N2/c1-2-6-10-9(5-1)13-11-7-3-4-8-12(11)14-10/h1-7,12H,8H2.
What are the key properties of 1,10a-dihydrophenazine?
1,10a-dihydrophenazine has a molecular weight of 182.23 g/mol, XLogP of 1.15, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,10a-dihydrophenazine is sourced from PubChem (CID 77155903), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).