1-methyl-3-(piperidin-2-ylmethylamino)pyrrolidin-2-one

C11H21N3O — CID 106252871

IUPAC1-methyl-3-(piperidin-2-ylmethylamino)pyrrolidin-2-one
SMILESCN1CCC(NCC2CCCCN2)C1=O
InChIInChI=1S/C11H21N3O/c1-14-7-5-10(11(14)15)13-8-9-4-2-3-6-12-9/h9-10,12-13H,2-8H2,1H3
InChIKeyCNPWFJMLOFEQJX-UHFFFAOYSA-N
MW211.31 g/mol
LogP-0.05
Rot. Bonds3

About 1-methyl-3-(piperidin-2-ylmethylamino)pyrrolidin-2-one

1-methyl-3-(piperidin-2-ylmethylamino)pyrrolidin-2-one (PubChem CID 106252871) has the molecular formula C11H21N3O and a molecular weight of 211.31 g/mol. Its IUPAC name is 1-methyl-3-(piperidin-2-ylmethylamino)pyrrolidin-2-one.

Molecular Properties

Compound Name1-methyl-3-(piperidin-2-ylmethylamino)pyrrolidin-2-one
PubChem CID106252871
Molecular FormulaC11H21N3O
Molecular Weight211.31 g/mol
Exact Mass211.17
IUPAC Name1-methyl-3-(piperidin-2-ylmethylamino)pyrrolidin-2-one
SMILESCN1CCC(NCC2CCCCN2)C1=O
InChIInChI=1S/C11H21N3O/c1-14-7-5-10(11(14)15)13-8-9-4-2-3-6-12-9/h9-10,12-13H,2-8H2,1H3
InChIKeyCNPWFJMLOFEQJX-UHFFFAOYSA-N
XLogP-0.05
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 ≤ 5-0.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

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CID 106634067
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CID 106638714
1-methyl-3-(pyrrolidin-2-ylmethyl)pyrrolidin-2-one
CID 142209775
N-(1-methyl-2-oxopyrrolidin-3-yl)azepane-2-carboxamide
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1-methyl-N-(piperidin-2-ylmethyl)piperidin-4-amine
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3-[(4-hydroxycyclohexyl)methylamino]-1-methylpyrrolidin-2-one
CID 106133454
1-methyl-3-[(3-methylcyclopentyl)methylamino]pyrrolidin-2-one
CID 107412677
3-(1,3-dioxan-4-ylmethylamino)-1-methylpyrrolidin-2-one
CID 106257213
(2S)-N-(1-methyl-2-oxopyrrolidin-3-yl)pyrrolidine-2-carboxamide;hydrochloride
CID 119322682
1-(1-methylpiperidin-4-yl)-N-(piperidin-2-ylmethyl)methanamine
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ethane;N-methyl-1-piperidin-2-ylmethanamine
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CID 106632850

Frequently Asked Questions

What is the IUPAC name of 1-methyl-3-(piperidin-2-ylmethylamino)pyrrolidin-2-one?
The IUPAC name of 1-methyl-3-(piperidin-2-ylmethylamino)pyrrolidin-2-one (CID 106252871) is 1-methyl-3-(piperidin-2-ylmethylamino)pyrrolidin-2-one.
What is the SMILES notation for 1-methyl-3-(piperidin-2-ylmethylamino)pyrrolidin-2-one?
The canonical SMILES for 1-methyl-3-(piperidin-2-ylmethylamino)pyrrolidin-2-one is CN1CCC(NCC2CCCCN2)C1=O.
What is the InChIKey of 1-methyl-3-(piperidin-2-ylmethylamino)pyrrolidin-2-one?
The InChIKey is CNPWFJMLOFEQJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N3O/c1-14-7-5-10(11(14)15)13-8-9-4-2-3-6-12-9/h9-10,12-13H,2-8H2,1H3.
What are the key properties of 1-methyl-3-(piperidin-2-ylmethylamino)pyrrolidin-2-one?
1-methyl-3-(piperidin-2-ylmethylamino)pyrrolidin-2-one has a molecular weight of 211.31 g/mol, XLogP of -0.05, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-3-(piperidin-2-ylmethylamino)pyrrolidin-2-one is sourced from PubChem (CID 106252871), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).