10-methyl-2-(2-methyl-2-piperidin-1-ylpropanoyl)acridin-1-one

C23H26N2O2 — CID 70488130

IUPAC10-methyl-2-(2-methyl-2-piperidin-1-ylpropanoyl)acridin-1-one
SMILESCn1c2ccc(C(=O)C(C)(C)N3CCCCC3)c(=O)c-2cc2ccccc21
InChIInChI=1S/C23H26N2O2/c1-23(2,25-13-7-4-8-14-25)22(27)17-11-12-20-18(21(17)26)15-16-9-5-6-10-19(16)24(20)3/h5-6,9-12,15H,4,7-8,13-14H2,1-3H3
InChIKeyYALOSZDBBHMFMX-UHFFFAOYSA-N
MW362.47 g/mol
LogP4.09
Rot. Bonds3

About 10-methyl-2-(2-methyl-2-piperidin-1-ylpropanoyl)acridin-1-one

10-methyl-2-(2-methyl-2-piperidin-1-ylpropanoyl)acridin-1-one (PubChem CID 70488130) has the molecular formula C23H26N2O2 and a molecular weight of 362.47 g/mol. Its IUPAC name is 10-methyl-2-(2-methyl-2-piperidin-1-ylpropanoyl)acridin-1-one.

Molecular Properties

Compound Name10-methyl-2-(2-methyl-2-piperidin-1-ylpropanoyl)acridin-1-one
PubChem CID70488130
Molecular FormulaC23H26N2O2
Molecular Weight362.47 g/mol
Exact Mass362.20
IUPAC Name10-methyl-2-(2-methyl-2-piperidin-1-ylpropanoyl)acridin-1-one
SMILESCn1c2ccc(C(=O)C(C)(C)N3CCCCC3)c(=O)c-2cc2ccccc21
InChIInChI=1S/C23H26N2O2/c1-23(2,25-13-7-4-8-14-25)22(27)17-11-12-20-18(21(17)26)15-16-9-5-6-10-19(16)24(20)3/h5-6,9-12,15H,4,7-8,13-14H2,1-3H3
InChIKeyYALOSZDBBHMFMX-UHFFFAOYSA-N
XLogP4.09
TPSA42.31 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.47
LogP ≤ 54.09
H-Bond Donors ≤ 50
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 10-methyl-2-(2-methyl-2-piperidin-1-ylpropanoyl)acridin-1-one?
The IUPAC name of 10-methyl-2-(2-methyl-2-piperidin-1-ylpropanoyl)acridin-1-one (CID 70488130) is 10-methyl-2-(2-methyl-2-piperidin-1-ylpropanoyl)acridin-1-one.
What is the SMILES notation for 10-methyl-2-(2-methyl-2-piperidin-1-ylpropanoyl)acridin-1-one?
The canonical SMILES for 10-methyl-2-(2-methyl-2-piperidin-1-ylpropanoyl)acridin-1-one is Cn1c2ccc(C(=O)C(C)(C)N3CCCCC3)c(=O)c-2cc2ccccc21.
What is the InChIKey of 10-methyl-2-(2-methyl-2-piperidin-1-ylpropanoyl)acridin-1-one?
The InChIKey is YALOSZDBBHMFMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H26N2O2/c1-23(2,25-13-7-4-8-14-25)22(27)17-11-12-20-18(21(17)26)15-16-9-5-6-10-19(16)24(20)3/h5-6,9-12,15H,4,7-8,13-14H2,1-3H3.
What are the key properties of 10-methyl-2-(2-methyl-2-piperidin-1-ylpropanoyl)acridin-1-one?
10-methyl-2-(2-methyl-2-piperidin-1-ylpropanoyl)acridin-1-one has a molecular weight of 362.47 g/mol, XLogP of 4.09, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 10-methyl-2-(2-methyl-2-piperidin-1-ylpropanoyl)acridin-1-one is sourced from PubChem (CID 70488130), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).