2-(9-oxoacridin-10-yl)-N-(6-oxopiperidin-3-yl)acetamide

C20H19N3O3 — CID 60616940

IUPAC2-(9-oxoacridin-10-yl)-N-(6-oxopiperidin-3-yl)acetamide
SMILESO=C1CCC(NC(=O)Cn2c3ccccc3c(=O)c3ccccc32)CN1
InChIInChI=1S/C20H19N3O3/c24-18-10-9-13(11-21-18)22-19(25)12-23-16-7-3-1-5-14(16)20(26)15-6-2-4-8-17(15)23/h1-8,13H,9-12H2,(H,21,24)(H,22,25)
InChIKeySBBDYHSTHAUTDQ-UHFFFAOYSA-N
MW349.39 g/mol
LogP1.55
Rot. Bonds3

About 2-(9-oxoacridin-10-yl)-N-(6-oxopiperidin-3-yl)acetamide

2-(9-oxoacridin-10-yl)-N-(6-oxopiperidin-3-yl)acetamide (PubChem CID 60616940) has the molecular formula C20H19N3O3 and a molecular weight of 349.39 g/mol. Its IUPAC name is 2-(9-oxoacridin-10-yl)-N-(6-oxopiperidin-3-yl)acetamide.

Molecular Properties

Compound Name2-(9-oxoacridin-10-yl)-N-(6-oxopiperidin-3-yl)acetamide
PubChem CID60616940
Molecular FormulaC20H19N3O3
Molecular Weight349.39 g/mol
Exact Mass349.14
IUPAC Name2-(9-oxoacridin-10-yl)-N-(6-oxopiperidin-3-yl)acetamide
SMILESO=C1CCC(NC(=O)Cn2c3ccccc3c(=O)c3ccccc32)CN1
InChIInChI=1S/C20H19N3O3/c24-18-10-9-13(11-21-18)22-19(25)12-23-16-7-3-1-5-14(16)20(26)15-6-2-4-8-17(15)23/h1-8,13H,9-12H2,(H,21,24)(H,22,25)
InChIKeySBBDYHSTHAUTDQ-UHFFFAOYSA-N
XLogP1.55
TPSA80.20 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.39
LogP ≤ 51.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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 2-(9-oxoacridin-10-yl)-N-(6-oxopiperidin-3-yl)acetamide?
The IUPAC name of 2-(9-oxoacridin-10-yl)-N-(6-oxopiperidin-3-yl)acetamide (CID 60616940) is 2-(9-oxoacridin-10-yl)-N-(6-oxopiperidin-3-yl)acetamide.
What is the SMILES notation for 2-(9-oxoacridin-10-yl)-N-(6-oxopiperidin-3-yl)acetamide?
The canonical SMILES for 2-(9-oxoacridin-10-yl)-N-(6-oxopiperidin-3-yl)acetamide is O=C1CCC(NC(=O)Cn2c3ccccc3c(=O)c3ccccc32)CN1.
What is the InChIKey of 2-(9-oxoacridin-10-yl)-N-(6-oxopiperidin-3-yl)acetamide?
The InChIKey is SBBDYHSTHAUTDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19N3O3/c24-18-10-9-13(11-21-18)22-19(25)12-23-16-7-3-1-5-14(16)20(26)15-6-2-4-8-17(15)23/h1-8,13H,9-12H2,(H,21,24)(H,22,25).
What are the key properties of 2-(9-oxoacridin-10-yl)-N-(6-oxopiperidin-3-yl)acetamide?
2-(9-oxoacridin-10-yl)-N-(6-oxopiperidin-3-yl)acetamide has a molecular weight of 349.39 g/mol, XLogP of 1.55, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(9-oxoacridin-10-yl)-N-(6-oxopiperidin-3-yl)acetamide is sourced from PubChem (CID 60616940), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).