4-methylacridin-3-ol

C14H11NO — CID 135711163

IUPAC4-methylacridin-3-ol
SMILESCc1c(O)ccc2cc3ccccc3nc12
InChIInChI=1S/C14H11NO/c1-9-13(16)7-6-11-8-10-4-2-3-5-12(10)15-14(9)11/h2-8,16H,1H3
InChIKeyAAYPKYSKXKRZGV-UHFFFAOYSA-N
MW209.25 g/mol
LogP3.40
Rot. Bonds

About 4-methylacridin-3-ol

4-methylacridin-3-ol (PubChem CID 135711163) has the molecular formula C14H11NO and a molecular weight of 209.25 g/mol. Its IUPAC name is 4-methylacridin-3-ol.

Molecular Properties

Compound Name4-methylacridin-3-ol
PubChem CID135711163
Molecular FormulaC14H11NO
Molecular Weight209.25 g/mol
Exact Mass209.08
IUPAC Name4-methylacridin-3-ol
SMILESCc1c(O)ccc2cc3ccccc3nc12
InChIInChI=1S/C14H11NO/c1-9-13(16)7-6-11-8-10-4-2-3-5-12(10)15-14(9)11/h2-8,16H,1H3
InChIKeyAAYPKYSKXKRZGV-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 4-methylacridin-3-ol?
The IUPAC name of 4-methylacridin-3-ol (CID 135711163) is 4-methylacridin-3-ol.
What is the SMILES notation for 4-methylacridin-3-ol?
The canonical SMILES for 4-methylacridin-3-ol is Cc1c(O)ccc2cc3ccccc3nc12.
What is the InChIKey of 4-methylacridin-3-ol?
The InChIKey is AAYPKYSKXKRZGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11NO/c1-9-13(16)7-6-11-8-10-4-2-3-5-12(10)15-14(9)11/h2-8,16H,1H3.
What are the key properties of 4-methylacridin-3-ol?
4-methylacridin-3-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 4-methylacridin-3-ol is sourced from PubChem (CID 135711163), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).