1-[(2R)-2-methylpiperazin-1-yl]-2-(oxolan-2-yl)ethanone

C11H20N2O2 — CID 82704997

IUPAC1-[(2R)-2-methylpiperazin-1-yl]-2-(oxolan-2-yl)ethanone
SMILESC[C@@H]1CNCCN1C(=O)CC1CCCO1
InChIInChI=1S/C11H20N2O2/c1-9-8-12-4-5-13(9)11(14)7-10-3-2-6-15-10/h9-10,12H,2-8H2,1H3/t9-,10?/m1/s1
InChIKeyLJHVYQPAZLMMAU-YHMJZVADSA-N
MW212.29 g/mol
LogP0.38
Rot. Bonds2

About 1-[(2R)-2-methylpiperazin-1-yl]-2-(oxolan-2-yl)ethanone

1-[(2R)-2-methylpiperazin-1-yl]-2-(oxolan-2-yl)ethanone (PubChem CID 82704997) has the molecular formula C11H20N2O2 and a molecular weight of 212.29 g/mol. Its IUPAC name is 1-[(2R)-2-methylpiperazin-1-yl]-2-(oxolan-2-yl)ethanone.

Molecular Properties

Compound Name1-[(2R)-2-methylpiperazin-1-yl]-2-(oxolan-2-yl)ethanone
PubChem CID82704997
Molecular FormulaC11H20N2O2
Molecular Weight212.29 g/mol
Exact Mass212.15
IUPAC Name1-[(2R)-2-methylpiperazin-1-yl]-2-(oxolan-2-yl)ethanone
SMILESC[C@@H]1CNCCN1C(=O)CC1CCCO1
InChIInChI=1S/C11H20N2O2/c1-9-8-12-4-5-13(9)11(14)7-10-3-2-6-15-10/h9-10,12H,2-8H2,1H3/t9-,10?/m1/s1
InChIKeyLJHVYQPAZLMMAU-YHMJZVADSA-N
XLogP0.38
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.29
LogP ≤ 50.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-[(2R)-2-methylpiperazin-1-yl]-2-(oxolan-2-yl)ethanone with MolForge

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Related Compounds

1-(2-methylpiperazin-1-yl)-3-(oxan-2-yl)propan-1-one
CID 63951169
1-[2-(oxolan-2-yl)acetyl]piperazine-2-carbonitrile
CID 79085997
1-(2-methylpiperazin-1-yl)-2-(oxan-2-ylmethylsulfanyl)ethanone;hydrochloride
CID 119472660
1-(2,3-dimethylpiperazin-1-yl)-2-(oxan-2-yl)ethanone;hydrochloride
CID 120570972
1-[2-(1-methylimidazol-2-yl)piperazin-1-yl]-2-(oxolan-2-yl)ethanone;hydrochloride
CID 120880679
2-(3-methylcyclohexyl)-1-(2-methylpiperazin-1-yl)ethanone
CID 119472160
1-(2-methylpiperazin-1-yl)propan-1-one
CID 10820824
[(2S)-2-methylpiperazin-1-yl]-[3-[[(2S)-oxolan-2-yl]methoxy]phenyl]methanone
CID 124571660
4-methyl-1-[2-(oxolan-2-yl)acetyl]piperidine-2-carboxylic acid
CID 114421923
1-(2-methyl-3,3a,4,5,6,6a-hexahydro-2H-pyrrolo[2,3-c]pyrrol-1-yl)-2-(oxolan-2-yl)ethanone
CID 65160130
3-cyclohexyl-1-(2-methylpiperazin-1-yl)propan-1-one
CID 62672939
1-[2-(aminomethyl)-3-methylpiperidin-1-yl]-2-(oxolan-2-yl)ethanone
CID 65160741

Frequently Asked Questions

What is the IUPAC name of 1-[(2R)-2-methylpiperazin-1-yl]-2-(oxolan-2-yl)ethanone?
The IUPAC name of 1-[(2R)-2-methylpiperazin-1-yl]-2-(oxolan-2-yl)ethanone (CID 82704997) is 1-[(2R)-2-methylpiperazin-1-yl]-2-(oxolan-2-yl)ethanone.
What is the SMILES notation for 1-[(2R)-2-methylpiperazin-1-yl]-2-(oxolan-2-yl)ethanone?
The canonical SMILES for 1-[(2R)-2-methylpiperazin-1-yl]-2-(oxolan-2-yl)ethanone is C[C@@H]1CNCCN1C(=O)CC1CCCO1.
What is the InChIKey of 1-[(2R)-2-methylpiperazin-1-yl]-2-(oxolan-2-yl)ethanone?
The InChIKey is LJHVYQPAZLMMAU-YHMJZVADSA-N. The full InChI is InChI=1S/C11H20N2O2/c1-9-8-12-4-5-13(9)11(14)7-10-3-2-6-15-10/h9-10,12H,2-8H2,1H3/t9-,10?/m1/s1.
What are the key properties of 1-[(2R)-2-methylpiperazin-1-yl]-2-(oxolan-2-yl)ethanone?
1-[(2R)-2-methylpiperazin-1-yl]-2-(oxolan-2-yl)ethanone has a molecular weight of 212.29 g/mol, XLogP of 0.38, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2R)-2-methylpiperazin-1-yl]-2-(oxolan-2-yl)ethanone is sourced from PubChem (CID 82704997), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).