3-methyl-1-piperidin-3-ylpyrrole-2,5-dione

C10H14N2O2 — CID 63318859

IUPAC3-methyl-1-piperidin-3-ylpyrrole-2,5-dione
SMILESCC1=CC(=O)N(C2CCCNC2)C1=O
InChIInChI=1S/C10H14N2O2/c1-7-5-9(13)12(10(7)14)8-3-2-4-11-6-8/h5,8,11H,2-4,6H2,1H3
InChIKeyYRIZLEINISMKMJ-UHFFFAOYSA-N
MW194.23 g/mol
LogP0.05
Rot. Bonds1

About 3-methyl-1-piperidin-3-ylpyrrole-2,5-dione

3-methyl-1-piperidin-3-ylpyrrole-2,5-dione (PubChem CID 63318859) has the molecular formula C10H14N2O2 and a molecular weight of 194.23 g/mol. Its IUPAC name is 3-methyl-1-piperidin-3-ylpyrrole-2,5-dione.

Molecular Properties

Compound Name3-methyl-1-piperidin-3-ylpyrrole-2,5-dione
PubChem CID63318859
Molecular FormulaC10H14N2O2
Molecular Weight194.23 g/mol
Exact Mass194.11
IUPAC Name3-methyl-1-piperidin-3-ylpyrrole-2,5-dione
SMILESCC1=CC(=O)N(C2CCCNC2)C1=O
InChIInChI=1S/C10H14N2O2/c1-7-5-9(13)12(10(7)14)8-3-2-4-11-6-8/h5,8,11H,2-4,6H2,1H3
InChIKeyYRIZLEINISMKMJ-UHFFFAOYSA-N
XLogP0.05
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.23
LogP ≤ 50.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'phthalimide', 'substructure': 'N/A'}

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Related Compounds

1-cyclooctyl-3-methylpyrrole-2,5-dione
CID 43236233
1-(4-hydroxycyclohexyl)-3-methylpyrrole-2,5-dione
CID 43346034
3-methyl-1-(1-methylazetidin-3-yl)pyrrole-2,5-dione
CID 131183418
2-piperidin-3-yl-6H-cyclohepta[c]pyrrole-1,3-dione
CID 123483046
1-(1,1-dioxothian-3-yl)-3-methylpyrrole-2,5-dione
CID 63921778
3-methyl-1-(1-propylpiperidin-4-yl)pyrrole-2,5-dione
CID 60976530
8-ethyl-3-piperidin-3-yl-1,3,8-triazaspiro[4.5]decane-2,4-dione
CID 167995828
5-methyl-1-piperidin-3-ylpyrimidine-2,4-dione
CID 51050595
4,6-dimethyl-2-[(3R)-piperidin-3-yl]pyridazin-3-one
CID 166162675
2,6-dimethyl-3-piperidin-3-ylpyrimidin-4-one
CID 126857734
4-ethyl-1-piperidin-3-ylimidazolidin-2-one
CID 116979000
5-methyl-1-[(3R)-piperidin-3-yl]piperidin-2-one
CID 166162657

Frequently Asked Questions

What is the IUPAC name of 3-methyl-1-piperidin-3-ylpyrrole-2,5-dione?
The IUPAC name of 3-methyl-1-piperidin-3-ylpyrrole-2,5-dione (CID 63318859) is 3-methyl-1-piperidin-3-ylpyrrole-2,5-dione.
What is the SMILES notation for 3-methyl-1-piperidin-3-ylpyrrole-2,5-dione?
The canonical SMILES for 3-methyl-1-piperidin-3-ylpyrrole-2,5-dione is CC1=CC(=O)N(C2CCCNC2)C1=O.
What is the InChIKey of 3-methyl-1-piperidin-3-ylpyrrole-2,5-dione?
The InChIKey is YRIZLEINISMKMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O2/c1-7-5-9(13)12(10(7)14)8-3-2-4-11-6-8/h5,8,11H,2-4,6H2,1H3.
What are the key properties of 3-methyl-1-piperidin-3-ylpyrrole-2,5-dione?
3-methyl-1-piperidin-3-ylpyrrole-2,5-dione has a molecular weight of 194.23 g/mol, XLogP of 0.05, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-1-piperidin-3-ylpyrrole-2,5-dione is sourced from PubChem (CID 63318859), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).