Acridine Orange Base

C17H19N3 — CID 62344

IUPAC3-N,3-N,6-N,6-N-tetramethylacridine-3,6-diamine
SMILESCN(C)C1=CC2=C(C=C1)C=C3C=CC(=CC3=N2)N(C)C
InChIInChI=1S/C17H19N3/c1-19(2)14-7-5-12-9-13-6-8-15(20(3)4)11-17(13)18-16(12)10-14/h5-11H,1-4H3
InChIKeyDPKHZNPWBDQZCN-UHFFFAOYSA-N
MW265.35 g/mol
LogP3.40
Rot. Bonds2

About Acridine Orange Base

Acridine Orange Base (PubChem CID 62344) has the molecular formula C17H19N3 and a molecular weight of 265.35 g/mol. Its IUPAC name is 3-N,3-N,6-N,6-N-tetramethylacridine-3,6-diamine.

Molecular Properties

Compound NameAcridine Orange Base
PubChem CID62344
Molecular FormulaC17H19N3
Molecular Weight265.35 g/mol
Exact Mass265.16
IUPAC Name3-N,3-N,6-N,6-N-tetramethylacridine-3,6-diamine
SMILESCN(C)C1=CC2=C(C=C1)C=C3C=CC(=CC3=N2)N(C)C
InChIInChI=1S/C17H19N3/c1-19(2)14-7-5-12-9-13-6-8-15(20(3)4)11-17(13)18-16(12)10-14/h5-11H,1-4H3
InChIKeyDPKHZNPWBDQZCN-UHFFFAOYSA-N
XLogP3.40
TPSA19.40 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity298

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.35
LogP ≤ 53.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

Tacrine
CID 1935
Dequalinium Chloride
CID 10649
Proflavine
CID 7099
Acridine
CID 9215
Pyrvinium
CID 5281035
Acriflavine
CID 443101
Dequalinium
CID 2993
Tacrine Hydrochloride
CID 2723754
9-Aminoacridine
CID 7019
Ethidium Bromide
CID 14710
2-Methylquinoline
CID 7060
9-Aminoacridine hydrochloride
CID 8643

Frequently Asked Questions

What is the IUPAC name of Acridine Orange Base?
The IUPAC name of Acridine Orange Base (CID 62344) is 3-N,3-N,6-N,6-N-tetramethylacridine-3,6-diamine.
What is the SMILES notation for Acridine Orange Base?
The canonical SMILES for Acridine Orange Base is CN(C)C1=CC2=C(C=C1)C=C3C=CC(=CC3=N2)N(C)C.
What is the InChIKey of Acridine Orange Base?
The InChIKey is DPKHZNPWBDQZCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N3/c1-19(2)14-7-5-12-9-13-6-8-15(20(3)4)11-17(13)18-16(12)10-14/h5-11H,1-4H3.
What are the key properties of Acridine Orange Base?
Acridine Orange Base has a molecular weight of 265.35 g/mol, XLogP of 3.40, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for Acridine Orange Base is sourced from PubChem (CID 62344), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).