2-[2-[(2-chloro-1,3-thiazol-5-yl)sulfonylamino]ethoxy]acetamide

C7H10ClN3O4S2 — CID 106235531

IUPAC2-[2-[(2-chloro-1,3-thiazol-5-yl)sulfonylamino]ethoxy]acetamide
SMILESNC(=O)COCCNS(=O)(=O)c1cnc(Cl)s1
InChIInChI=1S/C7H10ClN3O4S2/c8-7-10-3-6(16-7)17(13,14)11-1-2-15-4-5(9)12/h3,11H,1-2,4H2,(H2,9,12)
InChIKeyVHKRWJFXIQSCNZ-UHFFFAOYSA-N
MW299.76 g/mol
LogP-0.42
Rot. Bonds7

About 2-[2-[(2-chloro-1,3-thiazol-5-yl)sulfonylamino]ethoxy]acetamide

2-[2-[(2-chloro-1,3-thiazol-5-yl)sulfonylamino]ethoxy]acetamide (PubChem CID 106235531) has the molecular formula C7H10ClN3O4S2 and a molecular weight of 299.76 g/mol. Its IUPAC name is 2-[2-[(2-chloro-1,3-thiazol-5-yl)sulfonylamino]ethoxy]acetamide.

Molecular Properties

Compound Name2-[2-[(2-chloro-1,3-thiazol-5-yl)sulfonylamino]ethoxy]acetamide
PubChem CID106235531
Molecular FormulaC7H10ClN3O4S2
Molecular Weight299.76 g/mol
Exact Mass298.98
IUPAC Name2-[2-[(2-chloro-1,3-thiazol-5-yl)sulfonylamino]ethoxy]acetamide
SMILESNC(=O)COCCNS(=O)(=O)c1cnc(Cl)s1
InChIInChI=1S/C7H10ClN3O4S2/c8-7-10-3-6(16-7)17(13,14)11-1-2-15-4-5(9)12/h3,11H,1-2,4H2,(H2,9,12)
InChIKeyVHKRWJFXIQSCNZ-UHFFFAOYSA-N
XLogP-0.42
TPSA111.38 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.76
LogP ≤ 5-0.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

2-chloro-N-(2-propan-2-yloxyethyl)-1,3-thiazole-5-sulfonamide
CID 104760009
2-chloro-N-(3-hydroxypropyl)-1,3-thiazole-5-sulfonamide
CID 61051529
2-[2-[(2-aminopyrimidin-5-yl)sulfonylamino]ethoxy]acetamide
CID 106241017
2-[2-[(5-carbamothioylthiophen-2-yl)sulfonylamino]ethoxy]acetamide
CID 106272189
3-[(2-chloro-1,3-thiazol-5-yl)sulfonylamino]-N-(2-methoxyethyl)propanamide
CID 113409837
2-chloro-N-[2-[2-methoxyethyl(methyl)amino]ethyl]-1,3-thiazole-5-sulfonamide
CID 62845217
2-[2-(benzenesulfonamido)ethoxy]acetamide
CID 103766575
5-[2-(2-amino-2-oxoethoxy)ethylsulfamoyl]-1H-pyrazole-4-carboxylic acid
CID 106234889
2-chloro-N-[3-[methyl(propan-2-yl)amino]propyl]-1,3-thiazole-5-sulfonamide
CID 106033856
2-[2-[(6-cyano-3-pyridinyl)sulfonylamino]ethoxy]acetamide
CID 103837965
2-chloro-N-[2-(1,2,4-oxadiazol-5-yl)ethyl]-1,3-thiazole-5-sulfonamide
CID 106396401
2-chloro-N-(2-methoxypropyl)-1,3-thiazole-5-sulfonamide
CID 102697806

Frequently Asked Questions

What is the IUPAC name of 2-[2-[(2-chloro-1,3-thiazol-5-yl)sulfonylamino]ethoxy]acetamide?
The IUPAC name of 2-[2-[(2-chloro-1,3-thiazol-5-yl)sulfonylamino]ethoxy]acetamide (CID 106235531) is 2-[2-[(2-chloro-1,3-thiazol-5-yl)sulfonylamino]ethoxy]acetamide.
What is the SMILES notation for 2-[2-[(2-chloro-1,3-thiazol-5-yl)sulfonylamino]ethoxy]acetamide?
The canonical SMILES for 2-[2-[(2-chloro-1,3-thiazol-5-yl)sulfonylamino]ethoxy]acetamide is NC(=O)COCCNS(=O)(=O)c1cnc(Cl)s1.
What is the InChIKey of 2-[2-[(2-chloro-1,3-thiazol-5-yl)sulfonylamino]ethoxy]acetamide?
The InChIKey is VHKRWJFXIQSCNZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10ClN3O4S2/c8-7-10-3-6(16-7)17(13,14)11-1-2-15-4-5(9)12/h3,11H,1-2,4H2,(H2,9,12).
What are the key properties of 2-[2-[(2-chloro-1,3-thiazol-5-yl)sulfonylamino]ethoxy]acetamide?
2-[2-[(2-chloro-1,3-thiazol-5-yl)sulfonylamino]ethoxy]acetamide has a molecular weight of 299.76 g/mol, XLogP of -0.42, 7 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[(2-chloro-1,3-thiazol-5-yl)sulfonylamino]ethoxy]acetamide is sourced from PubChem (CID 106235531), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).