2-amino-N-[2-(1,2,4-oxadiazol-5-yl)ethyl]ethanesulfonamide

C6H12N4O3S — CID 106395892

IUPAC2-amino-N-[2-(1,2,4-oxadiazol-5-yl)ethyl]ethanesulfonamide
SMILESNCCS(=O)(=O)NCCc1ncno1
InChIInChI=1S/C6H12N4O3S/c7-2-4-14(11,12)10-3-1-6-8-5-9-13-6/h5,10H,1-4,7H2
InChIKeyFDARGULQCICMBV-UHFFFAOYSA-N
MW220.25 g/mol
LogP-1.51
Rot. Bonds6

About 2-amino-N-[2-(1,2,4-oxadiazol-5-yl)ethyl]ethanesulfonamide

2-amino-N-[2-(1,2,4-oxadiazol-5-yl)ethyl]ethanesulfonamide (PubChem CID 106395892) has the molecular formula C6H12N4O3S and a molecular weight of 220.25 g/mol. Its IUPAC name is 2-amino-N-[2-(1,2,4-oxadiazol-5-yl)ethyl]ethanesulfonamide.

Molecular Properties

Compound Name2-amino-N-[2-(1,2,4-oxadiazol-5-yl)ethyl]ethanesulfonamide
PubChem CID106395892
Molecular FormulaC6H12N4O3S
Molecular Weight220.25 g/mol
Exact Mass220.06
IUPAC Name2-amino-N-[2-(1,2,4-oxadiazol-5-yl)ethyl]ethanesulfonamide
SMILESNCCS(=O)(=O)NCCc1ncno1
InChIInChI=1S/C6H12N4O3S/c7-2-4-14(11,12)10-3-1-6-8-5-9-13-6/h5,10H,1-4,7H2
InChIKeyFDARGULQCICMBV-UHFFFAOYSA-N
XLogP-1.51
TPSA111.11 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.25
LogP ≤ 5-1.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

N-[2-(1,2,4-oxadiazol-5-yl)ethyl]-2-(propylamino)ethanesulfonamide
CID 114185436
N-[2-(1,2,4-oxadiazol-5-yl)ethyl]-3-(propan-2-ylamino)propane-1-sulfonamide
CID 114184201
2-(2-aminophenoxy)-N-[2-(1,2,4-oxadiazol-5-yl)ethyl]ethanesulfonamide
CID 106392325
1-[3-(hydroxymethyl)phenyl]-N-[2-(1,2,4-oxadiazol-5-yl)ethyl]methanesulfonamide
CID 106410575
2-amino-N-[2-(1H-1,2,4-triazol-5-yl)ethyl]ethanesulfonamide
CID 64532031
4-amino-2,6-dichloro-N-[2-(1,2,4-oxadiazol-5-yl)ethyl]benzenesulfonamide
CID 106392197
1-(3-aminopropyl)-N-[2-(1,2,4-oxadiazol-5-yl)ethyl]pyrazole-4-sulfonamide
CID 106411125
3-(aminomethyl)-4-methyl-N-[2-(1,2,4-oxadiazol-5-yl)ethyl]benzenesulfonamide
CID 106411175
2-hydrazinyl-N-[2-(1,2,4-oxadiazol-5-yl)ethyl]pyridine-4-sulfonamide
CID 106401561
6-amino-2,3-dimethyl-N-[2-(1,2,4-oxadiazol-5-yl)ethyl]benzenesulfonamide
CID 106392251
3-amino-2,4-dichloro-N-[2-(1,2,4-oxadiazol-5-yl)ethyl]benzenesulfonamide
CID 106392278
2-chloro-N-[2-(1,2,4-oxadiazol-5-yl)ethyl]-1,3-thiazole-5-sulfonamide
CID 106396401

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[2-(1,2,4-oxadiazol-5-yl)ethyl]ethanesulfonamide?
The IUPAC name of 2-amino-N-[2-(1,2,4-oxadiazol-5-yl)ethyl]ethanesulfonamide (CID 106395892) is 2-amino-N-[2-(1,2,4-oxadiazol-5-yl)ethyl]ethanesulfonamide.
What is the SMILES notation for 2-amino-N-[2-(1,2,4-oxadiazol-5-yl)ethyl]ethanesulfonamide?
The canonical SMILES for 2-amino-N-[2-(1,2,4-oxadiazol-5-yl)ethyl]ethanesulfonamide is NCCS(=O)(=O)NCCc1ncno1.
What is the InChIKey of 2-amino-N-[2-(1,2,4-oxadiazol-5-yl)ethyl]ethanesulfonamide?
The InChIKey is FDARGULQCICMBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12N4O3S/c7-2-4-14(11,12)10-3-1-6-8-5-9-13-6/h5,10H,1-4,7H2.
What are the key properties of 2-amino-N-[2-(1,2,4-oxadiazol-5-yl)ethyl]ethanesulfonamide?
2-amino-N-[2-(1,2,4-oxadiazol-5-yl)ethyl]ethanesulfonamide has a molecular weight of 220.25 g/mol, XLogP of -1.51, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[2-(1,2,4-oxadiazol-5-yl)ethyl]ethanesulfonamide is sourced from PubChem (CID 106395892), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).