1-methyl-3-[(3-methylcyclopentyl)methylamino]pyrrolidin-2-one

C12H22N2O — CID 107412677

IUPAC1-methyl-3-[(3-methylcyclopentyl)methylamino]pyrrolidin-2-one
SMILESCC1CCC(CNC2CCN(C)C2=O)C1
InChIInChI=1S/C12H22N2O/c1-9-3-4-10(7-9)8-13-11-5-6-14(2)12(11)15/h9-11,13H,3-8H2,1-2H3
InChIKeyKZQOKNQPJKXCJO-UHFFFAOYSA-N
MW210.32 g/mol
LogP1.24
Rot. Bonds3

About 1-methyl-3-[(3-methylcyclopentyl)methylamino]pyrrolidin-2-one

1-methyl-3-[(3-methylcyclopentyl)methylamino]pyrrolidin-2-one (PubChem CID 107412677) has the molecular formula C12H22N2O and a molecular weight of 210.32 g/mol. Its IUPAC name is 1-methyl-3-[(3-methylcyclopentyl)methylamino]pyrrolidin-2-one.

Molecular Properties

Compound Name1-methyl-3-[(3-methylcyclopentyl)methylamino]pyrrolidin-2-one
PubChem CID107412677
Molecular FormulaC12H22N2O
Molecular Weight210.32 g/mol
Exact Mass210.17
IUPAC Name1-methyl-3-[(3-methylcyclopentyl)methylamino]pyrrolidin-2-one
SMILESCC1CCC(CNC2CCN(C)C2=O)C1
InChIInChI=1S/C12H22N2O/c1-9-3-4-10(7-9)8-13-11-5-6-14(2)12(11)15/h9-11,13H,3-8H2,1-2H3
InChIKeyKZQOKNQPJKXCJO-UHFFFAOYSA-N
XLogP1.24
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.32
LogP ≤ 51.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-[(4-hydroxycyclohexyl)methylamino]-1-methylpyrrolidin-2-one
CID 106133454
3-[(3,5-dimethylcyclohex-3-en-1-yl)methylamino]-1-methylpyrrolidin-2-one
CID 106253467
3-[(3-methylcyclohexyl)methylamino]-1-(1-methylpyrazol-4-yl)pyrrolidin-2-one
CID 119128338
1-methyl-3-(piperidin-2-ylmethylamino)pyrrolidin-2-one
CID 106252871
1-[(3-methylcyclohexyl)methyl]-3-(propylamino)pyrrolidin-2-one
CID 114129785
(3S)-1-methyl-3-(methylamino)pyrrolidin-2-one
CID 94236128
3-[[(E)-but-2-enyl]amino]-1-methylpyrrolidin-2-one
CID 106256623
3-(1,3-dioxan-4-ylmethylamino)-1-methylpyrrolidin-2-one
CID 106257213
1-methyl-3-(3-propoxypropylamino)pyrrolidin-2-one
CID 82944318
N-[(3-methylcyclopentyl)methyl]azetidin-3-amine
CID 107412080
1-methyl-3-(2-methylidenebutylamino)pyrrolidin-2-one
CID 106256749
1-[4-[(3-methylcyclopentyl)methylamino]piperidin-1-yl]ethanone
CID 107411452

Frequently Asked Questions

What is the IUPAC name of 1-methyl-3-[(3-methylcyclopentyl)methylamino]pyrrolidin-2-one?
The IUPAC name of 1-methyl-3-[(3-methylcyclopentyl)methylamino]pyrrolidin-2-one (CID 107412677) is 1-methyl-3-[(3-methylcyclopentyl)methylamino]pyrrolidin-2-one.
What is the SMILES notation for 1-methyl-3-[(3-methylcyclopentyl)methylamino]pyrrolidin-2-one?
The canonical SMILES for 1-methyl-3-[(3-methylcyclopentyl)methylamino]pyrrolidin-2-one is CC1CCC(CNC2CCN(C)C2=O)C1.
What is the InChIKey of 1-methyl-3-[(3-methylcyclopentyl)methylamino]pyrrolidin-2-one?
The InChIKey is KZQOKNQPJKXCJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N2O/c1-9-3-4-10(7-9)8-13-11-5-6-14(2)12(11)15/h9-11,13H,3-8H2,1-2H3.
What are the key properties of 1-methyl-3-[(3-methylcyclopentyl)methylamino]pyrrolidin-2-one?
1-methyl-3-[(3-methylcyclopentyl)methylamino]pyrrolidin-2-one has a molecular weight of 210.32 g/mol, XLogP of 1.24, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-3-[(3-methylcyclopentyl)methylamino]pyrrolidin-2-one is sourced from PubChem (CID 107412677), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).