1-[(3-methylcyclopentyl)methyl]piperazin-2-one

C11H20N2O — CID 107415470

IUPAC1-[(3-methylcyclopentyl)methyl]piperazin-2-one
SMILESCC1CCC(CN2CCNCC2=O)C1
InChIInChI=1S/C11H20N2O/c1-9-2-3-10(6-9)8-13-5-4-12-7-11(13)14/h9-10,12H,2-8H2,1H3
InChIKeyNFOCQYRSJKOWEI-UHFFFAOYSA-N
MW196.29 g/mol
LogP0.85
Rot. Bonds2

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

1-[(3-methylcyclopentyl)methyl]piperazin-2-one (PubChem CID 107415470) has the molecular formula C11H20N2O and a molecular weight of 196.29 g/mol. Its IUPAC name is 1-[(3-methylcyclopentyl)methyl]piperazin-2-one.

Molecular Properties

Compound Name1-[(3-methylcyclopentyl)methyl]piperazin-2-one
PubChem CID107415470
Molecular FormulaC11H20N2O
Molecular Weight196.29 g/mol
Exact Mass196.16
IUPAC Name1-[(3-methylcyclopentyl)methyl]piperazin-2-one
SMILESCC1CCC(CN2CCNCC2=O)C1
InChIInChI=1S/C11H20N2O/c1-9-2-3-10(6-9)8-13-5-4-12-7-11(13)14/h9-10,12H,2-8H2,1H3
InChIKeyNFOCQYRSJKOWEI-UHFFFAOYSA-N
XLogP0.85
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 ≤ 50.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(cyclobutylmethyl)piperazin-2-one;hydrochloride
CID 67085388
1-(oxan-3-ylmethyl)piperazin-2-one
CID 64566013
1-[(4-methylcyclohexyl)methyl]imidazolidin-2-one
CID 115370654
1-[1-[(3-methylcyclohexyl)methyl]piperidin-3-yl]piperazin-2-one
CID 120844533
ethane;1-[(4-methylcyclohexyl)methyl]pyrrolidin-2-one
CID 162255523
1-hexylpiperazin-2-one
CID 62311409
3-[(3-methylcyclopentyl)methyl]-2-phenylimidazolidin-4-one
CID 107416096
N-(2-methylcyclopropyl)-2-(2-oxopiperazin-1-yl)acetamide
CID 119732239
1-(2-methylbutyl)piperazin-2-one;hydrobromide
CID 141488890
1-[(3-methylcyclopentyl)methyl]pyrrolidin-3-one
CID 107413455
1-[(1-methylsulfonylpiperidin-3-yl)methyl]-1,4-diazepan-2-one
CID 79622206
5-butyl-3-[(3-methylcyclopentyl)methyl]imidazolidin-4-one
CID 107416078

Frequently Asked Questions

What is the IUPAC name of 1-[(3-methylcyclopentyl)methyl]piperazin-2-one?
The IUPAC name of 1-[(3-methylcyclopentyl)methyl]piperazin-2-one (CID 107415470) is 1-[(3-methylcyclopentyl)methyl]piperazin-2-one.
What is the SMILES notation for 1-[(3-methylcyclopentyl)methyl]piperazin-2-one?
The canonical SMILES for 1-[(3-methylcyclopentyl)methyl]piperazin-2-one is CC1CCC(CN2CCNCC2=O)C1.
What is the InChIKey of 1-[(3-methylcyclopentyl)methyl]piperazin-2-one?
The InChIKey is NFOCQYRSJKOWEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O/c1-9-2-3-10(6-9)8-13-5-4-12-7-11(13)14/h9-10,12H,2-8H2,1H3.
What are the key properties of 1-[(3-methylcyclopentyl)methyl]piperazin-2-one?
1-[(3-methylcyclopentyl)methyl]piperazin-2-one has a molecular weight of 196.29 g/mol, XLogP of 0.85, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(3-methylcyclopentyl)methyl]piperazin-2-one is sourced from PubChem (CID 107415470), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).