N-[2-[2-methoxyethyl(methyl)amino]ethyl]piperazine-1-sulfonamide

C10H24N4O3S — CID 55126821

IUPACN-[2-[2-methoxyethyl(methyl)amino]ethyl]piperazine-1-sulfonamide
SMILESCOCCN(C)CCNS(=O)(=O)N1CCNCC1
InChIInChI=1S/C10H24N4O3S/c1-13(9-10-17-2)6-5-12-18(15,16)14-7-3-11-4-8-14/h11-12H,3-10H2,1-2H3
InChIKeyHZEIGDONYFXAPO-UHFFFAOYSA-N
MW280.39 g/mol
LogP-1.70
Rot. Bonds8

About N-[2-[2-methoxyethyl(methyl)amino]ethyl]piperazine-1-sulfonamide

N-[2-[2-methoxyethyl(methyl)amino]ethyl]piperazine-1-sulfonamide (PubChem CID 55126821) has the molecular formula C10H24N4O3S and a molecular weight of 280.39 g/mol. Its IUPAC name is N-[2-[2-methoxyethyl(methyl)amino]ethyl]piperazine-1-sulfonamide.

Molecular Properties

Compound NameN-[2-[2-methoxyethyl(methyl)amino]ethyl]piperazine-1-sulfonamide
PubChem CID55126821
Molecular FormulaC10H24N4O3S
Molecular Weight280.39 g/mol
Exact Mass280.16
IUPAC NameN-[2-[2-methoxyethyl(methyl)amino]ethyl]piperazine-1-sulfonamide
SMILESCOCCN(C)CCNS(=O)(=O)N1CCNCC1
InChIInChI=1S/C10H24N4O3S/c1-13(9-10-17-2)6-5-12-18(15,16)14-7-3-11-4-8-14/h11-12H,3-10H2,1-2H3
InChIKeyHZEIGDONYFXAPO-UHFFFAOYSA-N
XLogP-1.70
TPSA73.91 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.39
LogP ≤ 5-1.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[2-[2-methoxyethyl(methyl)amino]ethyl]piperazine-1-sulfonamide?
The IUPAC name of N-[2-[2-methoxyethyl(methyl)amino]ethyl]piperazine-1-sulfonamide (CID 55126821) is N-[2-[2-methoxyethyl(methyl)amino]ethyl]piperazine-1-sulfonamide.
What is the SMILES notation for N-[2-[2-methoxyethyl(methyl)amino]ethyl]piperazine-1-sulfonamide?
The canonical SMILES for N-[2-[2-methoxyethyl(methyl)amino]ethyl]piperazine-1-sulfonamide is COCCN(C)CCNS(=O)(=O)N1CCNCC1.
What is the InChIKey of N-[2-[2-methoxyethyl(methyl)amino]ethyl]piperazine-1-sulfonamide?
The InChIKey is HZEIGDONYFXAPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H24N4O3S/c1-13(9-10-17-2)6-5-12-18(15,16)14-7-3-11-4-8-14/h11-12H,3-10H2,1-2H3.
What are the key properties of N-[2-[2-methoxyethyl(methyl)amino]ethyl]piperazine-1-sulfonamide?
N-[2-[2-methoxyethyl(methyl)amino]ethyl]piperazine-1-sulfonamide has a molecular weight of 280.39 g/mol, XLogP of -1.70, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[2-methoxyethyl(methyl)amino]ethyl]piperazine-1-sulfonamide is sourced from PubChem (CID 55126821), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).