N-butyl-N-(2-methoxyethyl)butane-1-sulfonamide

C11H25NO3S — CID 89281501

IUPACN-butyl-N-(2-methoxyethyl)butane-1-sulfonamide
SMILESCCCCN(CCOC)S(=O)(=O)CCCC
InChIInChI=1S/C11H25NO3S/c1-4-6-8-12(9-10-15-3)16(13,14)11-7-5-2/h4-11H2,1-3H3
InChIKeyARQOCNDRNBMZNG-UHFFFAOYSA-N
MW251.39 g/mol
LogP1.86
Rot. Bonds10

About N-butyl-N-(2-methoxyethyl)butane-1-sulfonamide

N-butyl-N-(2-methoxyethyl)butane-1-sulfonamide (PubChem CID 89281501) has the molecular formula C11H25NO3S and a molecular weight of 251.39 g/mol. Its IUPAC name is N-butyl-N-(2-methoxyethyl)butane-1-sulfonamide.

Molecular Properties

Compound NameN-butyl-N-(2-methoxyethyl)butane-1-sulfonamide
PubChem CID89281501
Molecular FormulaC11H25NO3S
Molecular Weight251.39 g/mol
Exact Mass251.16
IUPAC NameN-butyl-N-(2-methoxyethyl)butane-1-sulfonamide
SMILESCCCCN(CCOC)S(=O)(=O)CCCC
InChIInChI=1S/C11H25NO3S/c1-4-6-8-12(9-10-15-3)16(13,14)11-7-5-2/h4-11H2,1-3H3
InChIKeyARQOCNDRNBMZNG-UHFFFAOYSA-N
XLogP1.86
TPSA46.61 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.39
LogP ≤ 51.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-butyl-N-(2-methoxyethyl)butane-1-sulfonamide?
The IUPAC name of N-butyl-N-(2-methoxyethyl)butane-1-sulfonamide (CID 89281501) is N-butyl-N-(2-methoxyethyl)butane-1-sulfonamide.
What is the SMILES notation for N-butyl-N-(2-methoxyethyl)butane-1-sulfonamide?
The canonical SMILES for N-butyl-N-(2-methoxyethyl)butane-1-sulfonamide is CCCCN(CCOC)S(=O)(=O)CCCC.
What is the InChIKey of N-butyl-N-(2-methoxyethyl)butane-1-sulfonamide?
The InChIKey is ARQOCNDRNBMZNG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H25NO3S/c1-4-6-8-12(9-10-15-3)16(13,14)11-7-5-2/h4-11H2,1-3H3.
What are the key properties of N-butyl-N-(2-methoxyethyl)butane-1-sulfonamide?
N-butyl-N-(2-methoxyethyl)butane-1-sulfonamide has a molecular weight of 251.39 g/mol, XLogP of 1.86, 10 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-butyl-N-(2-methoxyethyl)butane-1-sulfonamide is sourced from PubChem (CID 89281501), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).