1-(4-methylquinolin-8-yl)piperidin-4-one

C15H16N2O — CID 46236776

IUPAC1-(4-methylquinolin-8-yl)piperidin-4-one
SMILESCc1ccnc2c(N3CCC(=O)CC3)cccc12
InChIInChI=1S/C15H16N2O/c1-11-5-8-16-15-13(11)3-2-4-14(15)17-9-6-12(18)7-10-17/h2-5,8H,6-7,9-10H2,1H3
InChIKeyAXJXUUHFEPFOON-UHFFFAOYSA-N
MW240.31 g/mol
LogP2.71
Rot. Bonds1

About 1-(4-methylquinolin-8-yl)piperidin-4-one

1-(4-methylquinolin-8-yl)piperidin-4-one (PubChem CID 46236776) has the molecular formula C15H16N2O and a molecular weight of 240.31 g/mol. Its IUPAC name is 1-(4-methylquinolin-8-yl)piperidin-4-one.

Molecular Properties

Compound Name1-(4-methylquinolin-8-yl)piperidin-4-one
PubChem CID46236776
Molecular FormulaC15H16N2O
Molecular Weight240.31 g/mol
Exact Mass240.13
IUPAC Name1-(4-methylquinolin-8-yl)piperidin-4-one
SMILESCc1ccnc2c(N3CCC(=O)CC3)cccc12
InChIInChI=1S/C15H16N2O/c1-11-5-8-16-15-13(11)3-2-4-14(15)17-9-6-12(18)7-10-17/h2-5,8H,6-7,9-10H2,1H3
InChIKeyAXJXUUHFEPFOON-UHFFFAOYSA-N
XLogP2.71
TPSA33.20 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.31
LogP ≤ 52.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 1-(4-methylquinolin-8-yl)piperidin-4-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-quinolin-4-ylpiperidin-4-one
CID 22000285
(1R,2S,6R,7S)-4-(4-methylquinolin-8-yl)-4-azatricyclo[5.2.1.02,6]dec-8-ene-3,5-dione
CID 7070628
1-(4-methyl-3-pyridinyl)piperidin-4-one
CID 63327430
4-methylquinoline-8-carboxylic acid
CID 12597844
1-(4-methylquinolin-8-yl)ethanol
CID 82575957
1-[1-(8-methylquinolin-4-yl)piperidin-4-yl]piperidin-2-one
CID 133369326
1-(2-hydroxyphenyl)piperidin-4-one
CID 71419745
1-(2-methylphenyl)pyrrolidin-3-one
CID 23052785
1-(4-methylphthalazin-1-yl)piperidin-4-one
CID 43395101
1-(2-iodophenyl)piperidin-4-one
CID 28978342
4,7-bis(4-pyrrolidin-1-ylnaphthalen-1-yl)-1,10-phenanthroline
CID 177091262
aluminum tris(4-methylquinoline-8-carboxylate)
CID 23160254

Frequently Asked Questions

What is the IUPAC name of 1-(4-methylquinolin-8-yl)piperidin-4-one?
The IUPAC name of 1-(4-methylquinolin-8-yl)piperidin-4-one (CID 46236776) is 1-(4-methylquinolin-8-yl)piperidin-4-one.
What is the SMILES notation for 1-(4-methylquinolin-8-yl)piperidin-4-one?
The canonical SMILES for 1-(4-methylquinolin-8-yl)piperidin-4-one is Cc1ccnc2c(N3CCC(=O)CC3)cccc12.
What is the InChIKey of 1-(4-methylquinolin-8-yl)piperidin-4-one?
The InChIKey is AXJXUUHFEPFOON-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2O/c1-11-5-8-16-15-13(11)3-2-4-14(15)17-9-6-12(18)7-10-17/h2-5,8H,6-7,9-10H2,1H3.
What are the key properties of 1-(4-methylquinolin-8-yl)piperidin-4-one?
1-(4-methylquinolin-8-yl)piperidin-4-one has a molecular weight of 240.31 g/mol, XLogP of 2.71, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methylquinolin-8-yl)piperidin-4-one is sourced from PubChem (CID 46236776), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).