4-[(1-methylpiperidin-4-yl)methylamino]pyrrolidin-2-one

C11H21N3O — CID 106184277

IUPAC4-[(1-methylpiperidin-4-yl)methylamino]pyrrolidin-2-one
SMILESCN1CCC(CNC2CNC(=O)C2)CC1
InChIInChI=1S/C11H21N3O/c1-14-4-2-9(3-5-14)7-12-10-6-11(15)13-8-10/h9-10,12H,2-8H2,1H3,(H,13,15)
InChIKeyGIHMYAAYDBKVTI-UHFFFAOYSA-N
MW211.31 g/mol
LogP-0.19
Rot. Bonds3

About 4-[(1-methylpiperidin-4-yl)methylamino]pyrrolidin-2-one

4-[(1-methylpiperidin-4-yl)methylamino]pyrrolidin-2-one (PubChem CID 106184277) has the molecular formula C11H21N3O and a molecular weight of 211.31 g/mol. Its IUPAC name is 4-[(1-methylpiperidin-4-yl)methylamino]pyrrolidin-2-one.

Molecular Properties

Compound Name4-[(1-methylpiperidin-4-yl)methylamino]pyrrolidin-2-one
PubChem CID106184277
Molecular FormulaC11H21N3O
Molecular Weight211.31 g/mol
Exact Mass211.17
IUPAC Name4-[(1-methylpiperidin-4-yl)methylamino]pyrrolidin-2-one
SMILESCN1CCC(CNC2CNC(=O)C2)CC1
InChIInChI=1S/C11H21N3O/c1-14-4-2-9(3-5-14)7-12-10-6-11(15)13-8-10/h9-10,12H,2-8H2,1H3,(H,13,15)
InChIKeyGIHMYAAYDBKVTI-UHFFFAOYSA-N
XLogP-0.19
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.31
LogP ≤ 5-0.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

5-[(1-methylpiperidin-4-yl)methylamino]piperidin-2-one
CID 63662590
4-[(4-tert-butylcyclohexyl)methylamino]pyrrolidin-2-one
CID 104665410
5-(cyclopentylmethylamino)piperidin-2-one
CID 63661692
4-(2-cyclopropylethylamino)pyrrolidin-2-one
CID 106189081
5-[(4-methylmorpholin-2-yl)methylamino]piperidin-2-one
CID 79171800
1-methyl-N-[(1-methylpiperidin-4-yl)methyl]piperidin-3-amine
CID 62657172
4-(cyclopentylmethylamino)azepan-2-one
CID 63905028
4-[2-(tert-butylamino)ethylamino]pyrrolidin-2-one
CID 106182603
1-[2-[(5-oxopyrrolidin-3-yl)amino]ethyl]imidazolidin-2-one
CID 106189480
N-[(1-methylpiperidin-4-yl)methyl]-4-propan-2-ylcyclohexan-1-amine
CID 62704648
6-[[6-[(1-methylpiperidin-4-yl)methylamino]-3-pyridinyl]methylamino]-2,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-3-one
CID 171362688
4-[(1-cyclopropylpyrrolidin-3-yl)methylamino]azepan-2-one
CID 63903892

Frequently Asked Questions

What is the IUPAC name of 4-[(1-methylpiperidin-4-yl)methylamino]pyrrolidin-2-one?
The IUPAC name of 4-[(1-methylpiperidin-4-yl)methylamino]pyrrolidin-2-one (CID 106184277) is 4-[(1-methylpiperidin-4-yl)methylamino]pyrrolidin-2-one.
What is the SMILES notation for 4-[(1-methylpiperidin-4-yl)methylamino]pyrrolidin-2-one?
The canonical SMILES for 4-[(1-methylpiperidin-4-yl)methylamino]pyrrolidin-2-one is CN1CCC(CNC2CNC(=O)C2)CC1.
What is the InChIKey of 4-[(1-methylpiperidin-4-yl)methylamino]pyrrolidin-2-one?
The InChIKey is GIHMYAAYDBKVTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N3O/c1-14-4-2-9(3-5-14)7-12-10-6-11(15)13-8-10/h9-10,12H,2-8H2,1H3,(H,13,15).
What are the key properties of 4-[(1-methylpiperidin-4-yl)methylamino]pyrrolidin-2-one?
4-[(1-methylpiperidin-4-yl)methylamino]pyrrolidin-2-one has a molecular weight of 211.31 g/mol, XLogP of -0.19, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(1-methylpiperidin-4-yl)methylamino]pyrrolidin-2-one is sourced from PubChem (CID 106184277), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).