2-[bis(2-methoxyethyl)sulfamoyl]acetic acid

C8H17NO6S — CID 43173100

IUPAC2-[bis(2-methoxyethyl)sulfamoyl]acetic acid
SMILESCOCCN(CCOC)S(=O)(=O)CC(=O)O
InChIInChI=1S/C8H17NO6S/c1-14-5-3-9(4-6-15-2)16(12,13)7-8(10)11/h3-7H2,1-2H3,(H,10,11)
InChIKeyOFIYXKXDWOEPPX-UHFFFAOYSA-N
MW255.29 g/mol
LogP-1.00
Rot. Bonds9

About 2-[bis(2-methoxyethyl)sulfamoyl]acetic acid

2-[bis(2-methoxyethyl)sulfamoyl]acetic acid (PubChem CID 43173100) has the molecular formula C8H17NO6S and a molecular weight of 255.29 g/mol. Its IUPAC name is 2-[bis(2-methoxyethyl)sulfamoyl]acetic acid.

Molecular Properties

Compound Name2-[bis(2-methoxyethyl)sulfamoyl]acetic acid
PubChem CID43173100
Molecular FormulaC8H17NO6S
Molecular Weight255.29 g/mol
Exact Mass255.08
IUPAC Name2-[bis(2-methoxyethyl)sulfamoyl]acetic acid
SMILESCOCCN(CCOC)S(=O)(=O)CC(=O)O
InChIInChI=1S/C8H17NO6S/c1-14-5-3-9(4-6-15-2)16(12,13)7-8(10)11/h3-7H2,1-2H3,(H,10,11)
InChIKeyOFIYXKXDWOEPPX-UHFFFAOYSA-N
XLogP-1.00
TPSA93.14 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.29
LogP ≤ 5-1.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-[bis(2-methoxyethyl)sulfamoyl]acetic acid?
The IUPAC name of 2-[bis(2-methoxyethyl)sulfamoyl]acetic acid (CID 43173100) is 2-[bis(2-methoxyethyl)sulfamoyl]acetic acid.
What is the SMILES notation for 2-[bis(2-methoxyethyl)sulfamoyl]acetic acid?
The canonical SMILES for 2-[bis(2-methoxyethyl)sulfamoyl]acetic acid is COCCN(CCOC)S(=O)(=O)CC(=O)O.
What is the InChIKey of 2-[bis(2-methoxyethyl)sulfamoyl]acetic acid?
The InChIKey is OFIYXKXDWOEPPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17NO6S/c1-14-5-3-9(4-6-15-2)16(12,13)7-8(10)11/h3-7H2,1-2H3,(H,10,11).
What are the key properties of 2-[bis(2-methoxyethyl)sulfamoyl]acetic acid?
2-[bis(2-methoxyethyl)sulfamoyl]acetic acid has a molecular weight of 255.29 g/mol, XLogP of -1.00, 9 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[bis(2-methoxyethyl)sulfamoyl]acetic acid is sourced from PubChem (CID 43173100), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).