2,7-dimethylacridine-3,6-diamine;dihydrochloride

C15H17Cl2N3 — CID 23616360

IUPAC2,7-dimethylacridine-3,6-diamine;dihydrochloride
SMILESCc1cc2cc3cc(C)c(N)cc3nc2cc1N.Cl.Cl
InChIInChI=1S/C15H15N3.2ClH/c1-8-3-10-5-11-4-9(2)13(17)7-15(11)18-14(10)6-12(8)16;;/h3-7H,16-17H2,1-2H3;2*1H
InChIKeyMAYXRPLMFZUAPG-UHFFFAOYSA-N
MW310.23 g/mol
LogP4.01
Rot. Bonds

About 2,7-dimethylacridine-3,6-diamine;dihydrochloride

2,7-dimethylacridine-3,6-diamine;dihydrochloride (PubChem CID 23616360) has the molecular formula C15H17Cl2N3 and a molecular weight of 310.23 g/mol. Its IUPAC name is 2,7-dimethylacridine-3,6-diamine;dihydrochloride.

Molecular Properties

Compound Name2,7-dimethylacridine-3,6-diamine;dihydrochloride
PubChem CID23616360
Molecular FormulaC15H17Cl2N3
Molecular Weight310.23 g/mol
Exact Mass309.08
IUPAC Name2,7-dimethylacridine-3,6-diamine;dihydrochloride
SMILESCc1cc2cc3cc(C)c(N)cc3nc2cc1N.Cl.Cl
InChIInChI=1S/C15H15N3.2ClH/c1-8-3-10-5-11-4-9(2)13(17)7-15(11)18-14(10)6-12(8)16;;/h3-7H,16-17H2,1-2H3;2*1H
InChIKeyMAYXRPLMFZUAPG-UHFFFAOYSA-N
XLogP4.01
TPSA64.93 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.23
LogP ≤ 54.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 2,7-dimethylacridine-3,6-diamine;dihydrochloride 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-amino-7-methylacridin-3-yl)-dimethylazanium chloride
CID 21509
8-N,3-dimethylphenazine-2,8-diamine;hydrochloride
CID 141272932
2-[(1E)-2-amino-3-methylbuta-1,3-dienyl]-3,6-dimethylquinolin-7-amine
CID 163892232
2-chloro-6,7-dimethylquinolin-3-amine
CID 114553740
6-methyl-2H-benzotriazol-5-amine
CID 55291516
3-methyltetracen-2-amine
CID 154953105
7-amino-6-methylquinoline-3-carboxylic acid
CID 129276404
2,6-dimethyl-1,3-benzothiazol-5-amine
CID 46912036
2,3-dimethylquinoxaline-6,7-diamine
CID 11513893
7-bromo-3-methylquinolin-2-amine;hydrochloride
CID 43865982
6-amino-5-methyl-1-benzothiophen-2-ol
CID 130788844
acridine;2-methylaniline
CID 174440557

Frequently Asked Questions

What is the IUPAC name of 2,7-dimethylacridine-3,6-diamine;dihydrochloride?
The IUPAC name of 2,7-dimethylacridine-3,6-diamine;dihydrochloride (CID 23616360) is 2,7-dimethylacridine-3,6-diamine;dihydrochloride.
What is the SMILES notation for 2,7-dimethylacridine-3,6-diamine;dihydrochloride?
The canonical SMILES for 2,7-dimethylacridine-3,6-diamine;dihydrochloride is Cc1cc2cc3cc(C)c(N)cc3nc2cc1N.Cl.Cl.
What is the InChIKey of 2,7-dimethylacridine-3,6-diamine;dihydrochloride?
The InChIKey is MAYXRPLMFZUAPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N3.2ClH/c1-8-3-10-5-11-4-9(2)13(17)7-15(11)18-14(10)6-12(8)16;;/h3-7H,16-17H2,1-2H3;2*1H.
What are the key properties of 2,7-dimethylacridine-3,6-diamine;dihydrochloride?
2,7-dimethylacridine-3,6-diamine;dihydrochloride has a molecular weight of 310.23 g/mol, XLogP of 4.01, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,7-dimethylacridine-3,6-diamine;dihydrochloride is sourced from PubChem (CID 23616360), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).