phenazine-2,3,7-triamine

C12H11N5 — CID 13244876

IUPACphenazine-2,3,7-triamine
SMILESNc1ccc2nc3cc(N)c(N)cc3nc2c1
InChIInChI=1S/C12H11N5/c13-6-1-2-9-10(3-6)17-12-5-8(15)7(14)4-11(12)16-9/h1-5H,13-15H2
InChIKeyNPSHKYRLDHUWLW-UHFFFAOYSA-N
MW225.25 g/mol
LogP1.53
Rot. Bonds

About phenazine-2,3,7-triamine

phenazine-2,3,7-triamine (PubChem CID 13244876) has the molecular formula C12H11N5 and a molecular weight of 225.25 g/mol. Its IUPAC name is phenazine-2,3,7-triamine.

Molecular Properties

Compound Namephenazine-2,3,7-triamine
PubChem CID13244876
Molecular FormulaC12H11N5
Molecular Weight225.25 g/mol
Exact Mass225.10
IUPAC Namephenazine-2,3,7-triamine
SMILESNc1ccc2nc3cc(N)c(N)cc3nc2c1
InChIInChI=1S/C12H11N5/c13-6-1-2-9-10(3-6)17-12-5-8(15)7(14)4-11(12)16-9/h1-5H,13-15H2
InChIKeyNPSHKYRLDHUWLW-UHFFFAOYSA-N
XLogP1.53
TPSA103.84 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.25
LogP ≤ 51.53
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze phenazine-2,3,7-triamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

6,7,8,9-tetrahydrophenazin-2-amine
CID 13491386
4-[7-amino-3-(3-sulfanylpropyl)quinoxalin-2-yl]butane-1-thiol
CID 143926490
4-[6-amino-3-(4-hydroxyphenyl)quinoxalin-2-yl]phenol;dihydrochloride
CID 135610078
acridine;acridine-3,6-diamine
CID 21276006
2,3-dimethylquinoxaline-6,7-diamine
CID 11513893
(3S,5R)-1-[6-amino-3-[(3S,5R)-3,5-diaminopiperidin-1-yl]quinoxalin-2-yl]piperidine-3,5-diamine
CID 69422026
ethane;quinoxalin-6-amine
CID 143926479
quinoline-2,6-diamine
CID 22018948
3,4-bis(ethenyl)aniline;ethane
CID 142131680
8-amino-2-sulfanylidene-1H-benzo[g]pteridin-4-one
CID 5417965
2-chloro-3-(2-phenylethynyl)quinoxalin-6-amine
CID 142701874
8-N,3-dimethylphenazine-2,8-diamine;hydrochloride
CID 141272932

Frequently Asked Questions

What is the IUPAC name of phenazine-2,3,7-triamine?
The IUPAC name of phenazine-2,3,7-triamine (CID 13244876) is phenazine-2,3,7-triamine.
What is the SMILES notation for phenazine-2,3,7-triamine?
The canonical SMILES for phenazine-2,3,7-triamine is Nc1ccc2nc3cc(N)c(N)cc3nc2c1.
What is the InChIKey of phenazine-2,3,7-triamine?
The InChIKey is NPSHKYRLDHUWLW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11N5/c13-6-1-2-9-10(3-6)17-12-5-8(15)7(14)4-11(12)16-9/h1-5H,13-15H2.
What are the key properties of phenazine-2,3,7-triamine?
phenazine-2,3,7-triamine has a molecular weight of 225.25 g/mol, XLogP of 1.53, 0 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for phenazine-2,3,7-triamine is sourced from PubChem (CID 13244876), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).