2-methylphenazin-1-amine

C13H11N3 — CID 19757586

IUPAC2-methylphenazin-1-amine
SMILESCc1ccc2nc3ccccc3nc2c1N
InChIInChI=1S/C13H11N3/c1-8-6-7-11-13(12(8)14)16-10-5-3-2-4-9(10)15-11/h2-7H,14H2,1H3
InChIKeyQGANSTMZHAARDB-UHFFFAOYSA-N
MW209.25 g/mol
LogP2.67
Rot. Bonds

About 2-methylphenazin-1-amine

2-methylphenazin-1-amine (PubChem CID 19757586) has the molecular formula C13H11N3 and a molecular weight of 209.25 g/mol. Its IUPAC name is 2-methylphenazin-1-amine.

Molecular Properties

Compound Name2-methylphenazin-1-amine
PubChem CID19757586
Molecular FormulaC13H11N3
Molecular Weight209.25 g/mol
Exact Mass209.10
IUPAC Name2-methylphenazin-1-amine
SMILESCc1ccc2nc3ccccc3nc2c1N
InChIInChI=1S/C13H11N3/c1-8-6-7-11-13(12(8)14)16-10-5-3-2-4-9(10)15-11/h2-7H,14H2,1H3
InChIKeyQGANSTMZHAARDB-UHFFFAOYSA-N
XLogP2.67
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.25
LogP ≤ 52.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-methylphenazin-1-amine?
The IUPAC name of 2-methylphenazin-1-amine (CID 19757586) is 2-methylphenazin-1-amine.
What is the SMILES notation for 2-methylphenazin-1-amine?
The canonical SMILES for 2-methylphenazin-1-amine is Cc1ccc2nc3ccccc3nc2c1N.
What is the InChIKey of 2-methylphenazin-1-amine?
The InChIKey is QGANSTMZHAARDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11N3/c1-8-6-7-11-13(12(8)14)16-10-5-3-2-4-9(10)15-11/h2-7H,14H2,1H3.
What are the key properties of 2-methylphenazin-1-amine?
2-methylphenazin-1-amine has a molecular weight of 209.25 g/mol, XLogP of 2.67, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methylphenazin-1-amine is sourced from PubChem (CID 19757586), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).