acridin-3-ol

C13H9NO — CID 135611794

IUPACacridin-3-ol
SMILESOc1ccc2cc3ccccc3nc2c1
InChIInChI=1S/C13H9NO/c15-11-6-5-10-7-9-3-1-2-4-12(9)14-13(10)8-11/h1-8,15H
InChIKeyPCQLWQDFGQKOAO-UHFFFAOYSA-N
MW195.22 g/mol
LogP3.09
Rot. Bonds

About acridin-3-ol

acridin-3-ol (PubChem CID 135611794) has the molecular formula C13H9NO and a molecular weight of 195.22 g/mol. Its IUPAC name is acridin-3-ol.

Molecular Properties

Compound Nameacridin-3-ol
PubChem CID135611794
Molecular FormulaC13H9NO
Molecular Weight195.22 g/mol
Exact Mass195.07
IUPAC Nameacridin-3-ol
SMILESOc1ccc2cc3ccccc3nc2c1
InChIInChI=1S/C13H9NO/c15-11-6-5-10-7-9-3-1-2-4-12(9)14-13(10)8-11/h1-8,15H
InChIKeyPCQLWQDFGQKOAO-UHFFFAOYSA-N
XLogP3.09
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.22
LogP ≤ 53.09
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-3-ol?
The IUPAC name of acridin-3-ol (CID 135611794) is acridin-3-ol.
What is the SMILES notation for acridin-3-ol?
The canonical SMILES for acridin-3-ol is Oc1ccc2cc3ccccc3nc2c1.
What is the InChIKey of acridin-3-ol?
The InChIKey is PCQLWQDFGQKOAO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H9NO/c15-11-6-5-10-7-9-3-1-2-4-12(9)14-13(10)8-11/h1-8,15H.
What are the key properties of acridin-3-ol?
acridin-3-ol has a molecular weight of 195.22 g/mol, XLogP of 3.09, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for acridin-3-ol is sourced from PubChem (CID 135611794), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).