acridin-9-amine

C13H10N2 — CID 7019

💊View drug profile → aminoacridine
IUPACacridin-9-amine
SMILESNc1c2ccccc2nc2ccccc12
InChIInChI=1S/C13H10N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1-8H,(H2,14,15)
InChIKeyXJGFWWJLMVZSIG-UHFFFAOYSA-N
MW194.24 g/mol
LogP2.97
Rot. Bonds

About acridin-9-amine

acridin-9-amine (PubChem CID 7019) has the molecular formula C13H10N2 and a molecular weight of 194.24 g/mol. Its IUPAC name is acridin-9-amine.

Molecular Properties

Compound Nameacridin-9-amine
PubChem CID7019
Molecular FormulaC13H10N2
Molecular Weight194.24 g/mol
Exact Mass194.08
IUPAC Nameacridin-9-amine
SMILESNc1c2ccccc2nc2ccccc12
InChIInChI=1S/C13H10N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1-8H,(H2,14,15)
InChIKeyXJGFWWJLMVZSIG-UHFFFAOYSA-N
XLogP2.97
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.24
LogP ≤ 52.97
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'}

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Related Compounds

Tacrine
CID 1935
Proflavine
CID 7099
Acridine
CID 9215
Benz(c)acridine
CID 9181
Dequalinium Chloride
CID 10649
Acridine Orange Base
CID 62344
Dequalinium
CID 2993
2-Methylquinoline
CID 7060
3,6-Diamino-10-methylacridinium Chloride
CID 6842
Tacrine Hydrochloride
CID 2723754
9-Aminoacridine hydrochloride
CID 8643
2-Aminoquinoline
CID 11379

Frequently Asked Questions

What is the IUPAC name of acridin-9-amine?
The IUPAC name of acridin-9-amine (CID 7019) is acridin-9-amine.
What is the SMILES notation for acridin-9-amine?
The canonical SMILES for acridin-9-amine is Nc1c2ccccc2nc2ccccc12.
What is the InChIKey of acridin-9-amine?
The InChIKey is XJGFWWJLMVZSIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1-8H,(H2,14,15).
What are the key properties of acridin-9-amine?
acridin-9-amine has a molecular weight of 194.24 g/mol, XLogP of 2.97, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for acridin-9-amine is sourced from PubChem (CID 7019), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).