3-methylacridin-4-ol

C14H11NO — CID 89346727

IUPAC3-methylacridin-4-ol
SMILESCc1ccc2cc3ccccc3nc2c1O
InChIInChI=1S/C14H11NO/c1-9-6-7-11-8-10-4-2-3-5-12(10)15-13(11)14(9)16/h2-8,16H,1H3
InChIKeyHYWIEEDCWLNGHP-UHFFFAOYSA-N
MW209.25 g/mol
LogP3.40
Rot. Bonds

About 3-methylacridin-4-ol

3-methylacridin-4-ol (PubChem CID 89346727) has the molecular formula C14H11NO and a molecular weight of 209.25 g/mol. Its IUPAC name is 3-methylacridin-4-ol.

Molecular Properties

Compound Name3-methylacridin-4-ol
PubChem CID89346727
Molecular FormulaC14H11NO
Molecular Weight209.25 g/mol
Exact Mass209.08
IUPAC Name3-methylacridin-4-ol
SMILESCc1ccc2cc3ccccc3nc2c1O
InChIInChI=1S/C14H11NO/c1-9-6-7-11-8-10-4-2-3-5-12(10)15-13(11)14(9)16/h2-8,16H,1H3
InChIKeyHYWIEEDCWLNGHP-UHFFFAOYSA-N
XLogP3.40
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.25
LogP ≤ 53.40
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 3-methylacridin-4-ol?
The IUPAC name of 3-methylacridin-4-ol (CID 89346727) is 3-methylacridin-4-ol.
What is the SMILES notation for 3-methylacridin-4-ol?
The canonical SMILES for 3-methylacridin-4-ol is Cc1ccc2cc3ccccc3nc2c1O.
What is the InChIKey of 3-methylacridin-4-ol?
The InChIKey is HYWIEEDCWLNGHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11NO/c1-9-6-7-11-8-10-4-2-3-5-12(10)15-13(11)14(9)16/h2-8,16H,1H3.
What are the key properties of 3-methylacridin-4-ol?
3-methylacridin-4-ol has a molecular weight of 209.25 g/mol, XLogP of 3.40, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methylacridin-4-ol is sourced from PubChem (CID 89346727), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).