2-amino-N-(2-sulfamoylethyl)butanamide

C6H15N3O3S — CID 43649629

IUPAC2-amino-N-(2-sulfamoylethyl)butanamide
SMILESCCC(N)C(=O)NCCS(N)(=O)=O
InChIInChI=1S/C6H15N3O3S/c1-2-5(7)6(10)9-3-4-13(8,11)12/h5H,2-4,7H2,1H3,(H,9,10)(H2,8,11,12)
InChIKeySQDIOLCMHAXNTR-UHFFFAOYSA-N
MW209.27 g/mol
LogP-1.87
Rot. Bonds5

About 2-amino-N-(2-sulfamoylethyl)butanamide

2-amino-N-(2-sulfamoylethyl)butanamide (PubChem CID 43649629) has the molecular formula C6H15N3O3S and a molecular weight of 209.27 g/mol. Its IUPAC name is 2-amino-N-(2-sulfamoylethyl)butanamide.

Molecular Properties

Compound Name2-amino-N-(2-sulfamoylethyl)butanamide
PubChem CID43649629
Molecular FormulaC6H15N3O3S
Molecular Weight209.27 g/mol
Exact Mass209.08
IUPAC Name2-amino-N-(2-sulfamoylethyl)butanamide
SMILESCCC(N)C(=O)NCCS(N)(=O)=O
InChIInChI=1S/C6H15N3O3S/c1-2-5(7)6(10)9-3-4-13(8,11)12/h5H,2-4,7H2,1H3,(H,9,10)(H2,8,11,12)
InChIKeySQDIOLCMHAXNTR-UHFFFAOYSA-N
XLogP-1.87
TPSA115.28 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.27
LogP ≤ 5-1.87
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

Alz-801
CID 25008296
2-(2-Aminopropanoylamino)ethanesulfonic acid
CID 9899097
(1)-2-(Acetylamino)-4-mercaptobutyramide
CID 337022
Valyltaurine
CID 14332601
Alanyl-taurine
CID 15929422
N-ethyl-4-sulfamoylbutanamide
CID 23588047
Sulfoethyl aspartamide
CID 87170406
(2S)-N-cyclohexyl-2-[2-(methylsulfamoyl)ethylamino]butanamide
CID 95144032
2-amino-4-methylsulfonyl-N-(2,2,2-trifluoroethyl)butanamide
CID 24692832
(2R)-2-amino-4-methylsulfonyl-N-(2,2,2-trifluoroethyl)butanamide
CID 28177537
(2R)-2-amino-4-methylsulfonyl-N-(2,2,2-trifluoroethyl)butanamide;hydrochloride
CID 130236375
2-amino-4-methylsulfonyl-N-(2,2,2-trifluoroethyl)butanamide;hydrochloride
CID 130236376

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(2-sulfamoylethyl)butanamide?
The IUPAC name of 2-amino-N-(2-sulfamoylethyl)butanamide (CID 43649629) is 2-amino-N-(2-sulfamoylethyl)butanamide.
What is the SMILES notation for 2-amino-N-(2-sulfamoylethyl)butanamide?
The canonical SMILES for 2-amino-N-(2-sulfamoylethyl)butanamide is CCC(N)C(=O)NCCS(N)(=O)=O.
What is the InChIKey of 2-amino-N-(2-sulfamoylethyl)butanamide?
The InChIKey is SQDIOLCMHAXNTR-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H15N3O3S/c1-2-5(7)6(10)9-3-4-13(8,11)12/h5H,2-4,7H2,1H3,(H,9,10)(H2,8,11,12).
What are the key properties of 2-amino-N-(2-sulfamoylethyl)butanamide?
2-amino-N-(2-sulfamoylethyl)butanamide has a molecular weight of 209.27 g/mol, XLogP of -1.87, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(2-sulfamoylethyl)butanamide is sourced from PubChem (CID 43649629), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).