3,4-dimethylacridin-9-amine

C15H14N2 — CID 141072687

IUPAC3,4-dimethylacridin-9-amine
SMILESCc1ccc2c(N)c3ccccc3nc2c1C
InChIInChI=1S/C15H14N2/c1-9-7-8-12-14(16)11-5-3-4-6-13(11)17-15(12)10(9)2/h3-8H,1-2H3,(H2,16,17)
InChIKeyKWTCDDZNGNLUQN-UHFFFAOYSA-N
MW222.29 g/mol
LogP3.59
Rot. Bonds

About 3,4-dimethylacridin-9-amine

3,4-dimethylacridin-9-amine (PubChem CID 141072687) has the molecular formula C15H14N2 and a molecular weight of 222.29 g/mol. Its IUPAC name is 3,4-dimethylacridin-9-amine.

Molecular Properties

Compound Name3,4-dimethylacridin-9-amine
PubChem CID141072687
Molecular FormulaC15H14N2
Molecular Weight222.29 g/mol
Exact Mass222.12
IUPAC Name3,4-dimethylacridin-9-amine
SMILESCc1ccc2c(N)c3ccccc3nc2c1C
InChIInChI=1S/C15H14N2/c1-9-7-8-12-14(16)11-5-3-4-6-13(11)17-15(12)10(9)2/h3-8H,1-2H3,(H2,16,17)
InChIKeyKWTCDDZNGNLUQN-UHFFFAOYSA-N
XLogP3.59
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.29
LogP ≤ 53.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'amino_acridine_A(46)', 'substructure': 'N/A'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}

Analyze 3,4-dimethylacridin-9-amine 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

3,4,9-trimethylacridine
CID 58813802
acridin-9-amine;λ2-plumbane
CID 173496858
2-fluoro-3-methylquinolin-4-amine
CID 141294686
1,3-dimethylphenazin-2-amine
CID 23333976
3-bromo-2-methylquinolin-4-amine;hydrochloride
CID 3022129
2-methylphenazin-1-amine
CID 19757586
9-aminoacridin-4-ol;(Z)-but-2-enedioic acid
CID 45105090
2-methylquinolin-4-amine
CID 162035180
1,3,4-trimethylphenazin-2-amine;hydrochloride
CID 69198812
4-methylbenzo[c]acridin-1-amine
CID 141428416
4-chloro-7,8-dimethyl-2-phenylquinoline
CID 43668735
7,8-dimethyl-2-propylquinolin-4-amine
CID 62204139

Frequently Asked Questions

What is the IUPAC name of 3,4-dimethylacridin-9-amine?
The IUPAC name of 3,4-dimethylacridin-9-amine (CID 141072687) is 3,4-dimethylacridin-9-amine.
What is the SMILES notation for 3,4-dimethylacridin-9-amine?
The canonical SMILES for 3,4-dimethylacridin-9-amine is Cc1ccc2c(N)c3ccccc3nc2c1C.
What is the InChIKey of 3,4-dimethylacridin-9-amine?
The InChIKey is KWTCDDZNGNLUQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N2/c1-9-7-8-12-14(16)11-5-3-4-6-13(11)17-15(12)10(9)2/h3-8H,1-2H3,(H2,16,17).
What are the key properties of 3,4-dimethylacridin-9-amine?
3,4-dimethylacridin-9-amine has a molecular weight of 222.29 g/mol, XLogP of 3.59, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4-dimethylacridin-9-amine is sourced from PubChem (CID 141072687), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).