acridin-9-ylmethanamine;hydrochloride

C14H13ClN2 — CID 146014034

IUPACacridin-9-ylmethanamine;hydrochloride
SMILESCl.NCc1c2ccccc2nc2ccccc12
InChIInChI=1S/C14H12N2.ClH/c15-9-12-10-5-1-3-7-13(10)16-14-8-4-2-6-11(12)14;/h1-8H,9,15H2;1H
InChIKeyGQTCDSJCOXISQJ-UHFFFAOYSA-N
MW244.73 g/mol
LogP3.27
Rot. Bonds1

About acridin-9-ylmethanamine;hydrochloride

acridin-9-ylmethanamine;hydrochloride (PubChem CID 146014034) has the molecular formula C14H13ClN2 and a molecular weight of 244.73 g/mol. Its IUPAC name is acridin-9-ylmethanamine;hydrochloride.

Molecular Properties

Compound Nameacridin-9-ylmethanamine;hydrochloride
PubChem CID146014034
Molecular FormulaC14H13ClN2
Molecular Weight244.73 g/mol
Exact Mass244.08
IUPAC Nameacridin-9-ylmethanamine;hydrochloride
SMILESCl.NCc1c2ccccc2nc2ccccc12
InChIInChI=1S/C14H12N2.ClH/c15-9-12-10-5-1-3-7-13(10)16-14-8-4-2-6-11(12)14;/h1-8H,9,15H2;1H
InChIKeyGQTCDSJCOXISQJ-UHFFFAOYSA-N
XLogP3.27
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.73
LogP ≤ 53.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of acridin-9-ylmethanamine;hydrochloride?
The IUPAC name of acridin-9-ylmethanamine;hydrochloride (CID 146014034) is acridin-9-ylmethanamine;hydrochloride.
What is the SMILES notation for acridin-9-ylmethanamine;hydrochloride?
The canonical SMILES for acridin-9-ylmethanamine;hydrochloride is Cl.NCc1c2ccccc2nc2ccccc12.
What is the InChIKey of acridin-9-ylmethanamine;hydrochloride?
The InChIKey is GQTCDSJCOXISQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12N2.ClH/c15-9-12-10-5-1-3-7-13(10)16-14-8-4-2-6-11(12)14;/h1-8H,9,15H2;1H.
What are the key properties of acridin-9-ylmethanamine;hydrochloride?
acridin-9-ylmethanamine;hydrochloride has a molecular weight of 244.73 g/mol, XLogP of 3.27, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for acridin-9-ylmethanamine;hydrochloride is sourced from PubChem (CID 146014034), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).