2-methyl-7-piperidin-1-ylquinoline-5,8-dione

C15H16N2O2 — CID 15502953

IUPAC2-methyl-7-piperidin-1-ylquinoline-5,8-dione
SMILESCc1ccc2c(n1)C(=O)C(N1CCCCC1)=CC2=O
InChIInChI=1S/C15H16N2O2/c1-10-5-6-11-13(18)9-12(15(19)14(11)16-10)17-7-3-2-4-8-17/h5-6,9H,2-4,7-8H2,1H3
InChIKeyFXJVHVFJFYDHIS-UHFFFAOYSA-N
MW256.30 g/mol
LogP2.14
Rot. Bonds1

About 2-methyl-7-piperidin-1-ylquinoline-5,8-dione

2-methyl-7-piperidin-1-ylquinoline-5,8-dione (PubChem CID 15502953) has the molecular formula C15H16N2O2 and a molecular weight of 256.30 g/mol. Its IUPAC name is 2-methyl-7-piperidin-1-ylquinoline-5,8-dione.

Molecular Properties

Compound Name2-methyl-7-piperidin-1-ylquinoline-5,8-dione
PubChem CID15502953
Molecular FormulaC15H16N2O2
Molecular Weight256.30 g/mol
Exact Mass256.12
IUPAC Name2-methyl-7-piperidin-1-ylquinoline-5,8-dione
SMILESCc1ccc2c(n1)C(=O)C(N1CCCCC1)=CC2=O
InChIInChI=1S/C15H16N2O2/c1-10-5-6-11-13(18)9-12(15(19)14(11)16-10)17-7-3-2-4-8-17/h5-6,9H,2-4,7-8H2,1H3
InChIKeyFXJVHVFJFYDHIS-UHFFFAOYSA-N
XLogP2.14
TPSA50.27 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.30
LogP ≤ 52.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'quinone_A(370)', 'substructure': 'N/A'}

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Related Compounds

6-(Phenylamino)-5,8-quinolinedione
CID 3976
7-Amino-2-(pyridin-2-yl)quinoline-5,8-dione
CID 21771691
3-(Dimethylamino)-1-(6-methyl-3-pyridinyl)-2-propen-1-one
CID 5714022
5,8-Dihydroquinoline-5,8-dione
CID 388306
3-Methylpyrido[3,2-g]quinoline-5,10-dione
CID 13126949
5,8-Quinolinedione, 6-((3-dibutylamino)propyl)amino-
CID 99151
[2-Methyl-6-(trifluoromethyl)pyridin-3-yl](piperidino)methanone
CID 2796058
2-methyl-N-(2-methyl-5,8-dioxoquinolin-7-yl)propanamide
CID 10634934
7-Aminoquinoline-5,8-dione
CID 253688
7-Acetamidoquinoline-5,8-dione
CID 255471
7-Amino-2-methylquinoline-5,8-dione
CID 10976237
7-methyl-1,1-dioxo-4H-pyrido[2,3-g][1,4]benzothiazine-5,10-dione
CID 11608807

Frequently Asked Questions

What is the IUPAC name of 2-methyl-7-piperidin-1-ylquinoline-5,8-dione?
The IUPAC name of 2-methyl-7-piperidin-1-ylquinoline-5,8-dione (CID 15502953) is 2-methyl-7-piperidin-1-ylquinoline-5,8-dione.
What is the SMILES notation for 2-methyl-7-piperidin-1-ylquinoline-5,8-dione?
The canonical SMILES for 2-methyl-7-piperidin-1-ylquinoline-5,8-dione is Cc1ccc2c(n1)C(=O)C(N1CCCCC1)=CC2=O.
What is the InChIKey of 2-methyl-7-piperidin-1-ylquinoline-5,8-dione?
The InChIKey is FXJVHVFJFYDHIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2O2/c1-10-5-6-11-13(18)9-12(15(19)14(11)16-10)17-7-3-2-4-8-17/h5-6,9H,2-4,7-8H2,1H3.
What are the key properties of 2-methyl-7-piperidin-1-ylquinoline-5,8-dione?
2-methyl-7-piperidin-1-ylquinoline-5,8-dione has a molecular weight of 256.30 g/mol, XLogP of 2.14, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-7-piperidin-1-ylquinoline-5,8-dione is sourced from PubChem (CID 15502953), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).