2-[(2-amino-2-ethylbutyl)sulfamoyl]acetic acid

C8H18N2O4S — CID 115305990

IUPAC2-[(2-amino-2-ethylbutyl)sulfamoyl]acetic acid
SMILESCCC(N)(CC)CNS(=O)(=O)CC(=O)O
InChIInChI=1S/C8H18N2O4S/c1-3-8(9,4-2)6-10-15(13,14)5-7(11)12/h10H,3-6,9H2,1-2H3,(H,11,12)
InChIKeyAEJZYRSHUKEROL-UHFFFAOYSA-N
MW238.31 g/mol
LogP-0.49
Rot. Bonds7

About 2-[(2-amino-2-ethylbutyl)sulfamoyl]acetic acid

2-[(2-amino-2-ethylbutyl)sulfamoyl]acetic acid (PubChem CID 115305990) has the molecular formula C8H18N2O4S and a molecular weight of 238.31 g/mol. Its IUPAC name is 2-[(2-amino-2-ethylbutyl)sulfamoyl]acetic acid.

Molecular Properties

Compound Name2-[(2-amino-2-ethylbutyl)sulfamoyl]acetic acid
PubChem CID115305990
Molecular FormulaC8H18N2O4S
Molecular Weight238.31 g/mol
Exact Mass238.10
IUPAC Name2-[(2-amino-2-ethylbutyl)sulfamoyl]acetic acid
SMILESCCC(N)(CC)CNS(=O)(=O)CC(=O)O
InChIInChI=1S/C8H18N2O4S/c1-3-8(9,4-2)6-10-15(13,14)5-7(11)12/h10H,3-6,9H2,1-2H3,(H,11,12)
InChIKeyAEJZYRSHUKEROL-UHFFFAOYSA-N
XLogP-0.49
TPSA109.49 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.31
LogP ≤ 5-0.49
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

2-[(2-ethoxy-2-methylpropyl)sulfamoyl]acetic acid
CID 114940667
N-(2-amino-2-ethylbutyl)-2,2-dimethylpropane-1-sulfonamide
CID 115306037
2-(2,2,3,3-tetrafluoropropylsulfamoyl)acetic acid
CID 106290553
N-(2-amino-2-ethylbutyl)propane-2-sulfonamide
CID 115306044
methyl 2-[(2-amino-2-ethylbutyl)sulfamoylmethyl]benzoate
CID 119989981
carbonic acid;3-ethylpentan-3-amine;methanol
CID 174474253
N-(2-amino-2-ethylbutyl)-2-propylsulfonylacetamide
CID 119640214
N-(2-amino-2-methylpropyl)ethanesulfonamide
CID 115303418
N-[2-[(2-amino-2-ethylbutyl)sulfamoyl]ethyl]benzenesulfonamide;hydrochloride
CID 119990180
2-[(5-amino-5-oxopentyl)sulfamoyl]acetic acid
CID 106234815
1-(2-amino-2-ethylbutyl)-3-ethylurea
CID 115305864
2-[2-[(2-methylpropan-2-yl)oxycarbonylamino]ethylsulfamoyl]acetic acid
CID 114518058

Frequently Asked Questions

What is the IUPAC name of 2-[(2-amino-2-ethylbutyl)sulfamoyl]acetic acid?
The IUPAC name of 2-[(2-amino-2-ethylbutyl)sulfamoyl]acetic acid (CID 115305990) is 2-[(2-amino-2-ethylbutyl)sulfamoyl]acetic acid.
What is the SMILES notation for 2-[(2-amino-2-ethylbutyl)sulfamoyl]acetic acid?
The canonical SMILES for 2-[(2-amino-2-ethylbutyl)sulfamoyl]acetic acid is CCC(N)(CC)CNS(=O)(=O)CC(=O)O.
What is the InChIKey of 2-[(2-amino-2-ethylbutyl)sulfamoyl]acetic acid?
The InChIKey is AEJZYRSHUKEROL-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18N2O4S/c1-3-8(9,4-2)6-10-15(13,14)5-7(11)12/h10H,3-6,9H2,1-2H3,(H,11,12).
What are the key properties of 2-[(2-amino-2-ethylbutyl)sulfamoyl]acetic acid?
2-[(2-amino-2-ethylbutyl)sulfamoyl]acetic acid has a molecular weight of 238.31 g/mol, XLogP of -0.49, 7 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-amino-2-ethylbutyl)sulfamoyl]acetic acid is sourced from PubChem (CID 115305990), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).