2-methoxyacridin-3-amine

C14H12N2O — CID 150218886

IUPAC2-methoxyacridin-3-amine
SMILESCOc1cc2cc3ccccc3nc2cc1N
InChIInChI=1S/C14H12N2O/c1-17-14-7-10-6-9-4-2-3-5-12(9)16-13(10)8-11(14)15/h2-8H,15H2,1H3
InChIKeyFTBBXKBFJAYYSB-UHFFFAOYSA-N
MW224.26 g/mol
LogP2.98
Rot. Bonds1

About 2-methoxyacridin-3-amine

2-methoxyacridin-3-amine (PubChem CID 150218886) has the molecular formula C14H12N2O and a molecular weight of 224.26 g/mol. Its IUPAC name is 2-methoxyacridin-3-amine.

Molecular Properties

Compound Name2-methoxyacridin-3-amine
PubChem CID150218886
Molecular FormulaC14H12N2O
Molecular Weight224.26 g/mol
Exact Mass224.09
IUPAC Name2-methoxyacridin-3-amine
SMILESCOc1cc2cc3ccccc3nc2cc1N
InChIInChI=1S/C14H12N2O/c1-17-14-7-10-6-9-4-2-3-5-12(9)16-13(10)8-11(14)15/h2-8H,15H2,1H3
InChIKeyFTBBXKBFJAYYSB-UHFFFAOYSA-N
XLogP2.98
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.26
LogP ≤ 52.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

benzo[b]acridine
CID 6451416
acridine;ethane
CID 123684759
acridine
CID 21226281
acridine;2-methylaniline
CID 174440557
2-benzyl-3-methoxyquinoline
CID 159244403
acridine;acridine-3,6-diamine
CID 21276006
acridine;sulfane
CID 159134653
acridine;iron
CID 158030240
acridine;methane
CID 21324126
acridine;dihydrate
CID 172843020
acridine;argon
CID 157415582
2-(bromomethyl)-3-methoxyquinoline
CID 22036938

Frequently Asked Questions

What is the IUPAC name of 2-methoxyacridin-3-amine?
The IUPAC name of 2-methoxyacridin-3-amine (CID 150218886) is 2-methoxyacridin-3-amine.
What is the SMILES notation for 2-methoxyacridin-3-amine?
The canonical SMILES for 2-methoxyacridin-3-amine is COc1cc2cc3ccccc3nc2cc1N.
What is the InChIKey of 2-methoxyacridin-3-amine?
The InChIKey is FTBBXKBFJAYYSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12N2O/c1-17-14-7-10-6-9-4-2-3-5-12(9)16-13(10)8-11(14)15/h2-8H,15H2,1H3.
What are the key properties of 2-methoxyacridin-3-amine?
2-methoxyacridin-3-amine has a molecular weight of 224.26 g/mol, XLogP of 2.98, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxyacridin-3-amine is sourced from PubChem (CID 150218886), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).