6-methoxy-2,3,4,10-tetrahydro-1H-acridin-9-one

C14H15NO2 — CID 56676627

IUPAC6-methoxy-2,3,4,10-tetrahydro-1H-acridin-9-one
SMILESCOc1ccc2c(=O)c3c([nH]c2c1)CCCC3
InChIInChI=1S/C14H15NO2/c1-17-9-6-7-11-13(8-9)15-12-5-3-2-4-10(12)14(11)16/h6-8H,2-5H2,1H3,(H,15,16)
InChIKeyLSVXWLDSOHBOOX-UHFFFAOYSA-N
MW229.28 g/mol
LogP2.42
Rot. Bonds1

About 6-methoxy-2,3,4,10-tetrahydro-1H-acridin-9-one

6-methoxy-2,3,4,10-tetrahydro-1H-acridin-9-one (PubChem CID 56676627) has the molecular formula C14H15NO2 and a molecular weight of 229.28 g/mol. Its IUPAC name is 6-methoxy-2,3,4,10-tetrahydro-1H-acridin-9-one.

Molecular Properties

Compound Name6-methoxy-2,3,4,10-tetrahydro-1H-acridin-9-one
PubChem CID56676627
Molecular FormulaC14H15NO2
Molecular Weight229.28 g/mol
Exact Mass229.11
IUPAC Name6-methoxy-2,3,4,10-tetrahydro-1H-acridin-9-one
SMILESCOc1ccc2c(=O)c3c([nH]c2c1)CCCC3
InChIInChI=1S/C14H15NO2/c1-17-9-6-7-11-13(8-9)15-12-5-3-2-4-10(12)14(11)16/h6-8H,2-5H2,1H3,(H,15,16)
InChIKeyLSVXWLDSOHBOOX-UHFFFAOYSA-N
XLogP2.42
TPSA42.09 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.28
LogP ≤ 52.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6-methoxy-2,3,4,10-tetrahydro-1H-acridin-9-one?
The IUPAC name of 6-methoxy-2,3,4,10-tetrahydro-1H-acridin-9-one (CID 56676627) is 6-methoxy-2,3,4,10-tetrahydro-1H-acridin-9-one.
What is the SMILES notation for 6-methoxy-2,3,4,10-tetrahydro-1H-acridin-9-one?
The canonical SMILES for 6-methoxy-2,3,4,10-tetrahydro-1H-acridin-9-one is COc1ccc2c(=O)c3c([nH]c2c1)CCCC3.
What is the InChIKey of 6-methoxy-2,3,4,10-tetrahydro-1H-acridin-9-one?
The InChIKey is LSVXWLDSOHBOOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15NO2/c1-17-9-6-7-11-13(8-9)15-12-5-3-2-4-10(12)14(11)16/h6-8H,2-5H2,1H3,(H,15,16).
What are the key properties of 6-methoxy-2,3,4,10-tetrahydro-1H-acridin-9-one?
6-methoxy-2,3,4,10-tetrahydro-1H-acridin-9-one has a molecular weight of 229.28 g/mol, XLogP of 2.42, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-2,3,4,10-tetrahydro-1H-acridin-9-one is sourced from PubChem (CID 56676627), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).