N-[3-(2-methoxyethylsulfonylamino)propyl]acetamide

C8H18N2O4S — CID 110309562

IUPACN-[3-(2-methoxyethylsulfonylamino)propyl]acetamide
SMILESCOCCS(=O)(=O)NCCCNC(C)=O
InChIInChI=1S/C8H18N2O4S/c1-8(11)9-4-3-5-10-15(12,13)7-6-14-2/h10H,3-7H2,1-2H3,(H,9,11)
InChIKeyPGOXMMIPHCGQPA-UHFFFAOYSA-N
MW238.31 g/mol
LogP-0.92
Rot. Bonds8

About N-[3-(2-methoxyethylsulfonylamino)propyl]acetamide

N-[3-(2-methoxyethylsulfonylamino)propyl]acetamide (PubChem CID 110309562) has the molecular formula C8H18N2O4S and a molecular weight of 238.31 g/mol. Its IUPAC name is N-[3-(2-methoxyethylsulfonylamino)propyl]acetamide.

Molecular Properties

Compound NameN-[3-(2-methoxyethylsulfonylamino)propyl]acetamide
PubChem CID110309562
Molecular FormulaC8H18N2O4S
Molecular Weight238.31 g/mol
Exact Mass238.10
IUPAC NameN-[3-(2-methoxyethylsulfonylamino)propyl]acetamide
SMILESCOCCS(=O)(=O)NCCCNC(C)=O
InChIInChI=1S/C8H18N2O4S/c1-8(11)9-4-3-5-10-15(12,13)7-6-14-2/h10H,3-7H2,1-2H3,(H,9,11)
InChIKeyPGOXMMIPHCGQPA-UHFFFAOYSA-N
XLogP-0.92
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.31
LogP ≤ 5-0.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-[3-[2-(2-methoxyethoxy)ethylsulfonylamino]propyl]acetamide
CID 110630773
2-methoxy-N-(4-methoxybutyl)ethanesulfonamide
CID 110416443
N-(5-hydroxypentyl)-2-methoxyethanesulfonamide
CID 107319418
7-(2-methoxyethylsulfonylamino)heptanoic acid
CID 55010122
N-[3-(2-phenylethylsulfonylamino)propyl]acetamide
CID 110292134
N-(5-bromopentyl)-2-methoxyethanesulfonamide
CID 107323052
N-[3-(2-methoxyethoxy)propyl]acetamide
CID 60668585
N-(3-acetamidopropyl)acetamide
CID 5147555
4-(3-methoxypropylsulfamoyl)butanoic acid
CID 28513471
ethane;N-[3-(2-methoxyethoxy)propyl]acetamide
CID 177221846
N-[4-(2-methoxyethylcarbamoylamino)butyl]acetamide
CID 110415978
4-(2-methoxyethylsulfonylamino)-2-methylbutanoic acid
CID 80540283

Frequently Asked Questions

What is the IUPAC name of N-[3-(2-methoxyethylsulfonylamino)propyl]acetamide?
The IUPAC name of N-[3-(2-methoxyethylsulfonylamino)propyl]acetamide (CID 110309562) is N-[3-(2-methoxyethylsulfonylamino)propyl]acetamide.
What is the SMILES notation for N-[3-(2-methoxyethylsulfonylamino)propyl]acetamide?
The canonical SMILES for N-[3-(2-methoxyethylsulfonylamino)propyl]acetamide is COCCS(=O)(=O)NCCCNC(C)=O.
What is the InChIKey of N-[3-(2-methoxyethylsulfonylamino)propyl]acetamide?
The InChIKey is PGOXMMIPHCGQPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18N2O4S/c1-8(11)9-4-3-5-10-15(12,13)7-6-14-2/h10H,3-7H2,1-2H3,(H,9,11).
What are the key properties of N-[3-(2-methoxyethylsulfonylamino)propyl]acetamide?
N-[3-(2-methoxyethylsulfonylamino)propyl]acetamide has a molecular weight of 238.31 g/mol, XLogP of -0.92, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(2-methoxyethylsulfonylamino)propyl]acetamide is sourced from PubChem (CID 110309562), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).