4-(2-methoxyethyl)-N,3,5-trimethylpiperazine-1-sulfonamide

C10H23N3O3S — CID 110629141

IUPAC4-(2-methoxyethyl)-N,3,5-trimethylpiperazine-1-sulfonamide
SMILESCNS(=O)(=O)N1CC(C)N(CCOC)C(C)C1
InChIInChI=1S/C10H23N3O3S/c1-9-7-12(17(14,15)11-3)8-10(2)13(9)5-6-16-4/h9-11H,5-8H2,1-4H3
InChIKeyPNSGEXGOMONREK-UHFFFAOYSA-N
MW265.38 g/mol
LogP-0.51
Rot. Bonds5

About 4-(2-methoxyethyl)-N,3,5-trimethylpiperazine-1-sulfonamide

4-(2-methoxyethyl)-N,3,5-trimethylpiperazine-1-sulfonamide (PubChem CID 110629141) has the molecular formula C10H23N3O3S and a molecular weight of 265.38 g/mol. Its IUPAC name is 4-(2-methoxyethyl)-N,3,5-trimethylpiperazine-1-sulfonamide.

Molecular Properties

Compound Name4-(2-methoxyethyl)-N,3,5-trimethylpiperazine-1-sulfonamide
PubChem CID110629141
Molecular FormulaC10H23N3O3S
Molecular Weight265.38 g/mol
Exact Mass265.15
IUPAC Name4-(2-methoxyethyl)-N,3,5-trimethylpiperazine-1-sulfonamide
SMILESCNS(=O)(=O)N1CC(C)N(CCOC)C(C)C1
InChIInChI=1S/C10H23N3O3S/c1-9-7-12(17(14,15)11-3)8-10(2)13(9)5-6-16-4/h9-11H,5-8H2,1-4H3
InChIKeyPNSGEXGOMONREK-UHFFFAOYSA-N
XLogP-0.51
TPSA61.88 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.38
LogP ≤ 5-0.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-(2-methoxyethyl)-N,3,5-trimethylpiperazine-1-sulfonamide?
The IUPAC name of 4-(2-methoxyethyl)-N,3,5-trimethylpiperazine-1-sulfonamide (CID 110629141) is 4-(2-methoxyethyl)-N,3,5-trimethylpiperazine-1-sulfonamide.
What is the SMILES notation for 4-(2-methoxyethyl)-N,3,5-trimethylpiperazine-1-sulfonamide?
The canonical SMILES for 4-(2-methoxyethyl)-N,3,5-trimethylpiperazine-1-sulfonamide is CNS(=O)(=O)N1CC(C)N(CCOC)C(C)C1.
What is the InChIKey of 4-(2-methoxyethyl)-N,3,5-trimethylpiperazine-1-sulfonamide?
The InChIKey is PNSGEXGOMONREK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H23N3O3S/c1-9-7-12(17(14,15)11-3)8-10(2)13(9)5-6-16-4/h9-11H,5-8H2,1-4H3.
What are the key properties of 4-(2-methoxyethyl)-N,3,5-trimethylpiperazine-1-sulfonamide?
4-(2-methoxyethyl)-N,3,5-trimethylpiperazine-1-sulfonamide has a molecular weight of 265.38 g/mol, XLogP of -0.51, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-methoxyethyl)-N,3,5-trimethylpiperazine-1-sulfonamide is sourced from PubChem (CID 110629141), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).