2-amino-N-[2-oxo-2-[(5-sulfamoyl-1,3,4-thiadiazol-2-yl)amino]ethyl]acetamide

C6H10N6O4S2 — CID 10827620

IUPAC2-amino-N-[2-oxo-2-[(5-sulfamoyl-1,3,4-thiadiazol-2-yl)amino]ethyl]acetamide
SMILESNCC(=O)NCC(=O)Nc1nnc(S(N)(=O)=O)s1
InChIInChI=1S/C6H10N6O4S2/c7-1-3(13)9-2-4(14)10-5-11-12-6(17-5)18(8,15)16/h1-2,7H2,(H,9,13)(H2,8,15,16)(H,10,11,14)
InChIKeyOYAOKYMFRYPRMN-UHFFFAOYSA-N
MW294.32 g/mol
LogP-2.80
Rot. Bonds5

About 2-amino-N-[2-oxo-2-[(5-sulfamoyl-1,3,4-thiadiazol-2-yl)amino]ethyl]acetamide

2-amino-N-[2-oxo-2-[(5-sulfamoyl-1,3,4-thiadiazol-2-yl)amino]ethyl]acetamide (PubChem CID 10827620) has the molecular formula C6H10N6O4S2 and a molecular weight of 294.32 g/mol. Its IUPAC name is 2-amino-N-[2-oxo-2-[(5-sulfamoyl-1,3,4-thiadiazol-2-yl)amino]ethyl]acetamide.

Molecular Properties

Compound Name2-amino-N-[2-oxo-2-[(5-sulfamoyl-1,3,4-thiadiazol-2-yl)amino]ethyl]acetamide
PubChem CID10827620
Molecular FormulaC6H10N6O4S2
Molecular Weight294.32 g/mol
Exact Mass294.02
IUPAC Name2-amino-N-[2-oxo-2-[(5-sulfamoyl-1,3,4-thiadiazol-2-yl)amino]ethyl]acetamide
SMILESNCC(=O)NCC(=O)Nc1nnc(S(N)(=O)=O)s1
InChIInChI=1S/C6H10N6O4S2/c7-1-3(13)9-2-4(14)10-5-11-12-6(17-5)18(8,15)16/h1-2,7H2,(H,9,13)(H2,8,15,16)(H,10,11,14)
InChIKeyOYAOKYMFRYPRMN-UHFFFAOYSA-N
XLogP-2.80
TPSA170.16 Ų
H-Bond Donors4
H-Bond Acceptors8
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.32
LogP ≤ 5-2.80
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'N-acyl-2-amino-5-mercapto-1,3,4-_thiadiazole', 'substructure': 'N/A'}

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Related Compounds

4-amino-N-(5-sulfamoyl-1,3,4-thiadiazol-2-yl)butanamide
CID 10015713
[2-oxo-2-[(5-sulfamoyl-1,3,4-thiadiazol-2-yl)amino]ethyl]azanium bromide
CID 15041395
3-chloro-N-(5-sulfamoyl-1,3,4-thiadiazol-2-yl)propanamide
CID 54476371
(5-sulfamoyl-1,3,4-thiadiazol-2-yl)carbamothioic S-acid
CID 123430728
ethyl 6-oxo-6-[(5-sulfamoyl-1,3,4-thiadiazol-2-yl)amino]hexanoate
CID 3083283
1-(2-chloroethyl)-3-(5-sulfamoyl-1,3,4-thiadiazol-2-yl)urea
CID 3734828
2,2-diamino-N-(5-sulfamoyl-1,3,4-thiadiazol-2-yl)acetamide
CID 130452184
N-(5-sulfamoyl-1,3,4-thiadiazol-2-yl)-3-(trifluoromethylsulfonylamino)propanamide
CID 10833817
2-amino-N-[2-oxo-2-(1,3,4-thiadiazol-2-ylamino)ethyl]acetamide
CID 130157493
N-[3-oxo-3-[(5-sulfamoyl-1,3,4-thiadiazol-2-yl)amino]propyl]-2-propylpentanamide
CID 11760610
methyl N-[8-oxo-8-[(5-sulfamoyl-1,3,4-thiadiazol-2-yl)amino]octyl]carbamate
CID 178065843
3-(dimethylsulfamoylamino)-N-(5-sulfamoyl-1,3,4-thiadiazol-2-yl)propanamide
CID 101078048

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[2-oxo-2-[(5-sulfamoyl-1,3,4-thiadiazol-2-yl)amino]ethyl]acetamide?
The IUPAC name of 2-amino-N-[2-oxo-2-[(5-sulfamoyl-1,3,4-thiadiazol-2-yl)amino]ethyl]acetamide (CID 10827620) is 2-amino-N-[2-oxo-2-[(5-sulfamoyl-1,3,4-thiadiazol-2-yl)amino]ethyl]acetamide.
What is the SMILES notation for 2-amino-N-[2-oxo-2-[(5-sulfamoyl-1,3,4-thiadiazol-2-yl)amino]ethyl]acetamide?
The canonical SMILES for 2-amino-N-[2-oxo-2-[(5-sulfamoyl-1,3,4-thiadiazol-2-yl)amino]ethyl]acetamide is NCC(=O)NCC(=O)Nc1nnc(S(N)(=O)=O)s1.
What is the InChIKey of 2-amino-N-[2-oxo-2-[(5-sulfamoyl-1,3,4-thiadiazol-2-yl)amino]ethyl]acetamide?
The InChIKey is OYAOKYMFRYPRMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10N6O4S2/c7-1-3(13)9-2-4(14)10-5-11-12-6(17-5)18(8,15)16/h1-2,7H2,(H,9,13)(H2,8,15,16)(H,10,11,14).
What are the key properties of 2-amino-N-[2-oxo-2-[(5-sulfamoyl-1,3,4-thiadiazol-2-yl)amino]ethyl]acetamide?
2-amino-N-[2-oxo-2-[(5-sulfamoyl-1,3,4-thiadiazol-2-yl)amino]ethyl]acetamide has a molecular weight of 294.32 g/mol, XLogP of -2.80, 5 rotatable bonds, 4 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[2-oxo-2-[(5-sulfamoyl-1,3,4-thiadiazol-2-yl)amino]ethyl]acetamide is sourced from PubChem (CID 10827620), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).