4-methyl-1-(piperidin-2-ylmethyl)pyrrolidin-2-one

C11H20N2O — CID 63104427

IUPAC4-methyl-1-(piperidin-2-ylmethyl)pyrrolidin-2-one
SMILESCC1CC(=O)N(CC2CCCCN2)C1
InChIInChI=1S/C11H20N2O/c1-9-6-11(14)13(7-9)8-10-4-2-3-5-12-10/h9-10,12H,2-8H2,1H3
InChIKeyNGNRHNNTWDSIHS-UHFFFAOYSA-N
MW196.29 g/mol
LogP1.00
Rot. Bonds2

About 4-methyl-1-(piperidin-2-ylmethyl)pyrrolidin-2-one

4-methyl-1-(piperidin-2-ylmethyl)pyrrolidin-2-one (PubChem CID 63104427) has the molecular formula C11H20N2O and a molecular weight of 196.29 g/mol. Its IUPAC name is 4-methyl-1-(piperidin-2-ylmethyl)pyrrolidin-2-one.

Molecular Properties

Compound Name4-methyl-1-(piperidin-2-ylmethyl)pyrrolidin-2-one
PubChem CID63104427
Molecular FormulaC11H20N2O
Molecular Weight196.29 g/mol
Exact Mass196.16
IUPAC Name4-methyl-1-(piperidin-2-ylmethyl)pyrrolidin-2-one
SMILESCC1CC(=O)N(CC2CCCCN2)C1
InChIInChI=1S/C11H20N2O/c1-9-6-11(14)13(7-9)8-10-4-2-3-5-12-10/h9-10,12H,2-8H2,1H3
InChIKeyNGNRHNNTWDSIHS-UHFFFAOYSA-N
XLogP1.00
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.29
LogP ≤ 51.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-methyl-1-(2-piperidin-2-ylethyl)pyrrolidin-2-one
CID 63104430
1-(piperidin-2-ylmethyl)-4-propylimidazolidin-2-one
CID 116979133
4-cyclopentyl-3-methyl-1-(piperidin-2-ylmethyl)imidazolidin-2-one
CID 116981839
3,4-dimethyl-1-[[(2R)-pyrrolidin-2-yl]methyl]pyrrolidine-2,5-dione
CID 102819845
4-(1-methylpyrrolidin-3-yl)-1-(piperidin-2-ylmethyl)imidazolidin-2-one
CID 116979152
4-tert-butyl-1-(2-piperidin-2-ylethyl)pyrrolidin-2-one
CID 113421171
(2S)-2-[(3,4-dimethylpyrrolidin-1-yl)methyl]piperidine
CID 130522631
3-methyl-1-[[(2R)-pyrrolidin-2-yl]methyl]piperidin-2-one
CID 102819920
4-methyl-1-[[(2S)-piperidin-2-yl]methyl]piperidine
CID 7141723
(3R)-3-methyl-1-[[(2R)-piperidin-2-yl]methyl]piperidine
CID 124748585
(5S)-5-(aminomethyl)-3-(piperidin-2-ylmethyl)-1,3-oxazolidin-2-one
CID 115056721
4-tert-butyl-1-(pyrrolidin-2-ylmethyl)imidazolidin-2-one
CID 116979067

Frequently Asked Questions

What is the IUPAC name of 4-methyl-1-(piperidin-2-ylmethyl)pyrrolidin-2-one?
The IUPAC name of 4-methyl-1-(piperidin-2-ylmethyl)pyrrolidin-2-one (CID 63104427) is 4-methyl-1-(piperidin-2-ylmethyl)pyrrolidin-2-one.
What is the SMILES notation for 4-methyl-1-(piperidin-2-ylmethyl)pyrrolidin-2-one?
The canonical SMILES for 4-methyl-1-(piperidin-2-ylmethyl)pyrrolidin-2-one is CC1CC(=O)N(CC2CCCCN2)C1.
What is the InChIKey of 4-methyl-1-(piperidin-2-ylmethyl)pyrrolidin-2-one?
The InChIKey is NGNRHNNTWDSIHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O/c1-9-6-11(14)13(7-9)8-10-4-2-3-5-12-10/h9-10,12H,2-8H2,1H3.
What are the key properties of 4-methyl-1-(piperidin-2-ylmethyl)pyrrolidin-2-one?
4-methyl-1-(piperidin-2-ylmethyl)pyrrolidin-2-one has a molecular weight of 196.29 g/mol, XLogP of 1.00, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-1-(piperidin-2-ylmethyl)pyrrolidin-2-one is sourced from PubChem (CID 63104427), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).