(2R)-4-ethyl-1-(2-methoxyethylsulfonyl)-2-methylpiperazine

C10H22N2O3S — CID 122544420

IUPAC(2R)-4-ethyl-1-(2-methoxyethylsulfonyl)-2-methylpiperazine
SMILESCCN1CCN(S(=O)(=O)CCOC)[C@H](C)C1
InChIInChI=1S/C10H22N2O3S/c1-4-11-5-6-12(10(2)9-11)16(13,14)8-7-15-3/h10H,4-9H2,1-3H3/t10-/m1/s1
InChIKeyVLWSNGFVEYDZLM-SNVBAGLBSA-N
MW250.36 g/mol
LogP-0.01
Rot. Bonds5

About (2R)-4-ethyl-1-(2-methoxyethylsulfonyl)-2-methylpiperazine

(2R)-4-ethyl-1-(2-methoxyethylsulfonyl)-2-methylpiperazine (PubChem CID 122544420) has the molecular formula C10H22N2O3S and a molecular weight of 250.36 g/mol. Its IUPAC name is (2R)-4-ethyl-1-(2-methoxyethylsulfonyl)-2-methylpiperazine.

Molecular Properties

Compound Name(2R)-4-ethyl-1-(2-methoxyethylsulfonyl)-2-methylpiperazine
PubChem CID122544420
Molecular FormulaC10H22N2O3S
Molecular Weight250.36 g/mol
Exact Mass250.14
IUPAC Name(2R)-4-ethyl-1-(2-methoxyethylsulfonyl)-2-methylpiperazine
SMILESCCN1CCN(S(=O)(=O)CCOC)[C@H](C)C1
InChIInChI=1S/C10H22N2O3S/c1-4-11-5-6-12(10(2)9-11)16(13,14)8-7-15-3/h10H,4-9H2,1-3H3/t10-/m1/s1
InChIKeyVLWSNGFVEYDZLM-SNVBAGLBSA-N
XLogP-0.01
TPSA49.85 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.36
LogP ≤ 5-0.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

Cambridge id 6502799
CID 1529500
1-(2-Methoxyethyl)-2-methyl-4-(2-methylsulfonylethyl)piperazine
CID 53599014
1-(2-Ethoxyethyl)-2-methyl-4-(3-methylsulfonylpropyl)piperazine
CID 53605753
1-(2-Methoxyethyl)-2-methyl-4-(3-methylsulfonylpropyl)piperazine
CID 53609467
3-[4-(2-methoxyethyl)-3-methylpiperazin-1-yl]-N,N-dimethylpropane-1-sulfonamide
CID 53621690
1-Ethylsulfonyl-4-pentan-3-ylpiperazine
CID 777525
2-Ethyl-1-(2-methoxyethyl)-4-(2-methylsulfonylethyl)piperazine
CID 53599391
1-Cyclobutyl-4-(2-propan-2-yloxyethylsulfonyl)piperazine
CID 71979573
1-[(2S)-1-methoxypropan-2-yl]-4-methylsulfonylpiperazine
CID 96449422
1-Butan-2-yl-4-(2-fluoroethylsulfonyl)piperazine
CID 130440602
1-Ethylsulfonyl-4-propan-2-ylpiperazine
CID 740714
1-(Butan-2-yl)-4-(ethylsulfonyl)piperazine
CID 2901815

Frequently Asked Questions

What is the IUPAC name of (2R)-4-ethyl-1-(2-methoxyethylsulfonyl)-2-methylpiperazine?
The IUPAC name of (2R)-4-ethyl-1-(2-methoxyethylsulfonyl)-2-methylpiperazine (CID 122544420) is (2R)-4-ethyl-1-(2-methoxyethylsulfonyl)-2-methylpiperazine.
What is the SMILES notation for (2R)-4-ethyl-1-(2-methoxyethylsulfonyl)-2-methylpiperazine?
The canonical SMILES for (2R)-4-ethyl-1-(2-methoxyethylsulfonyl)-2-methylpiperazine is CCN1CCN(S(=O)(=O)CCOC)[C@H](C)C1.
What is the InChIKey of (2R)-4-ethyl-1-(2-methoxyethylsulfonyl)-2-methylpiperazine?
The InChIKey is VLWSNGFVEYDZLM-SNVBAGLBSA-N. The full InChI is InChI=1S/C10H22N2O3S/c1-4-11-5-6-12(10(2)9-11)16(13,14)8-7-15-3/h10H,4-9H2,1-3H3/t10-/m1/s1.
What are the key properties of (2R)-4-ethyl-1-(2-methoxyethylsulfonyl)-2-methylpiperazine?
(2R)-4-ethyl-1-(2-methoxyethylsulfonyl)-2-methylpiperazine has a molecular weight of 250.36 g/mol, XLogP of -0.01, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-4-ethyl-1-(2-methoxyethylsulfonyl)-2-methylpiperazine is sourced from PubChem (CID 122544420), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).