2-[2-[[3-(methylamino)-2-pyridinyl]sulfonylamino]ethoxy]acetamide

C10H16N4O4S — CID 106241007

IUPAC2-[2-[[3-(methylamino)-2-pyridinyl]sulfonylamino]ethoxy]acetamide
SMILESCNc1cccnc1S(=O)(=O)NCCOCC(N)=O
InChIInChI=1S/C10H16N4O4S/c1-12-8-3-2-4-13-10(8)19(16,17)14-5-6-18-7-9(11)15/h2-4,12,14H,5-7H2,1H3,(H2,11,15)
InChIKeyIGVGFZVZZGTNOH-UHFFFAOYSA-N
MW288.33 g/mol
LogP-1.10
Rot. Bonds8

About 2-[2-[[3-(methylamino)-2-pyridinyl]sulfonylamino]ethoxy]acetamide

2-[2-[[3-(methylamino)-2-pyridinyl]sulfonylamino]ethoxy]acetamide (PubChem CID 106241007) has the molecular formula C10H16N4O4S and a molecular weight of 288.33 g/mol. Its IUPAC name is 2-[2-[[3-(methylamino)-2-pyridinyl]sulfonylamino]ethoxy]acetamide.

Molecular Properties

Compound Name2-[2-[[3-(methylamino)-2-pyridinyl]sulfonylamino]ethoxy]acetamide
PubChem CID106241007
Molecular FormulaC10H16N4O4S
Molecular Weight288.33 g/mol
Exact Mass288.09
IUPAC Name2-[2-[[3-(methylamino)-2-pyridinyl]sulfonylamino]ethoxy]acetamide
SMILESCNc1cccnc1S(=O)(=O)NCCOCC(N)=O
InChIInChI=1S/C10H16N4O4S/c1-12-8-3-2-4-13-10(8)19(16,17)14-5-6-18-7-9(11)15/h2-4,12,14H,5-7H2,1H3,(H2,11,15)
InChIKeyIGVGFZVZZGTNOH-UHFFFAOYSA-N
XLogP-1.10
TPSA123.41 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.33
LogP ≤ 5-1.10
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-[2-[[3-(methylamino)-2-pyridinyl]sulfonylamino]ethoxy]acetamide?
The IUPAC name of 2-[2-[[3-(methylamino)-2-pyridinyl]sulfonylamino]ethoxy]acetamide (CID 106241007) is 2-[2-[[3-(methylamino)-2-pyridinyl]sulfonylamino]ethoxy]acetamide.
What is the SMILES notation for 2-[2-[[3-(methylamino)-2-pyridinyl]sulfonylamino]ethoxy]acetamide?
The canonical SMILES for 2-[2-[[3-(methylamino)-2-pyridinyl]sulfonylamino]ethoxy]acetamide is CNc1cccnc1S(=O)(=O)NCCOCC(N)=O.
What is the InChIKey of 2-[2-[[3-(methylamino)-2-pyridinyl]sulfonylamino]ethoxy]acetamide?
The InChIKey is IGVGFZVZZGTNOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4O4S/c1-12-8-3-2-4-13-10(8)19(16,17)14-5-6-18-7-9(11)15/h2-4,12,14H,5-7H2,1H3,(H2,11,15).
What are the key properties of 2-[2-[[3-(methylamino)-2-pyridinyl]sulfonylamino]ethoxy]acetamide?
2-[2-[[3-(methylamino)-2-pyridinyl]sulfonylamino]ethoxy]acetamide has a molecular weight of 288.33 g/mol, XLogP of -1.10, 8 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[[3-(methylamino)-2-pyridinyl]sulfonylamino]ethoxy]acetamide is sourced from PubChem (CID 106241007), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).