N-tert-butyl-2-(2-hydroxyethylsulfonylamino)acetamide

C8H18N2O4S — CID 115356606

IUPACN-tert-butyl-2-(2-hydroxyethylsulfonylamino)acetamide
SMILESCC(C)(C)NC(=O)CNS(=O)(=O)CCO
InChIInChI=1S/C8H18N2O4S/c1-8(2,3)10-7(12)6-9-15(13,14)5-4-11/h9,11H,4-6H2,1-3H3,(H,10,12)
InChIKeyKQGVSGPVSRADBK-UHFFFAOYSA-N
MW238.31 g/mol
LogP-1.19
Rot. Bonds5

About N-tert-butyl-2-(2-hydroxyethylsulfonylamino)acetamide

N-tert-butyl-2-(2-hydroxyethylsulfonylamino)acetamide (PubChem CID 115356606) has the molecular formula C8H18N2O4S and a molecular weight of 238.31 g/mol. Its IUPAC name is N-tert-butyl-2-(2-hydroxyethylsulfonylamino)acetamide.

Molecular Properties

Compound NameN-tert-butyl-2-(2-hydroxyethylsulfonylamino)acetamide
PubChem CID115356606
Molecular FormulaC8H18N2O4S
Molecular Weight238.31 g/mol
Exact Mass238.10
IUPAC NameN-tert-butyl-2-(2-hydroxyethylsulfonylamino)acetamide
SMILESCC(C)(C)NC(=O)CNS(=O)(=O)CCO
InChIInChI=1S/C8H18N2O4S/c1-8(2,3)10-7(12)6-9-15(13,14)5-4-11/h9,11H,4-6H2,1-3H3,(H,10,12)
InChIKeyKQGVSGPVSRADBK-UHFFFAOYSA-N
XLogP-1.19
TPSA95.50 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.31
LogP ≤ 5-1.19
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-tert-butyl-2-(2-piperidin-4-ylethylsulfonylamino)acetamide
CID 115356414
methyl 2-(2-hydroxyethylsulfonylamino)acetate
CID 79588455
N-tert-butyl-2-(2-ethylsulfonylethylamino)acetamide
CID 115356498
2-[(6-amino-3-pyridinyl)sulfonylamino]-N-tert-butylacetamide
CID 115355870
2-[(3-amino-2,5-dimethylphenyl)sulfonylamino]-N-tert-butylacetamide
CID 115355937
2-[(5-amino-2,3-difluorophenyl)sulfonylamino]-N-tert-butylacetamide
CID 115355883
2-[(3-amino-1-methylpyrazol-4-yl)sulfonylamino]-N-tert-butylacetamide
CID 115355880
N-tert-butyl-2-[[4-(ethylamino)phenyl]sulfonylamino]acetamide
CID 115357166
N-tert-butyl-2-[(4-fluoro-2,6-dimethylphenyl)sulfonylamino]acetamide
CID 107327346
2-[(3-amino-4-chlorophenyl)sulfonylamino]-N-tert-butylacetamide
CID 115355917
N-tert-butyl-2-[(4,4-dimethylcyclohexyl)sulfonylamino]acetamide
CID 99859346
N-tert-butyl-2-[(2-methyl-2-methylsulfonylpropyl)amino]acetamide
CID 79551841

Frequently Asked Questions

What is the IUPAC name of N-tert-butyl-2-(2-hydroxyethylsulfonylamino)acetamide?
The IUPAC name of N-tert-butyl-2-(2-hydroxyethylsulfonylamino)acetamide (CID 115356606) is N-tert-butyl-2-(2-hydroxyethylsulfonylamino)acetamide.
What is the SMILES notation for N-tert-butyl-2-(2-hydroxyethylsulfonylamino)acetamide?
The canonical SMILES for N-tert-butyl-2-(2-hydroxyethylsulfonylamino)acetamide is CC(C)(C)NC(=O)CNS(=O)(=O)CCO.
What is the InChIKey of N-tert-butyl-2-(2-hydroxyethylsulfonylamino)acetamide?
The InChIKey is KQGVSGPVSRADBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18N2O4S/c1-8(2,3)10-7(12)6-9-15(13,14)5-4-11/h9,11H,4-6H2,1-3H3,(H,10,12).
What are the key properties of N-tert-butyl-2-(2-hydroxyethylsulfonylamino)acetamide?
N-tert-butyl-2-(2-hydroxyethylsulfonylamino)acetamide has a molecular weight of 238.31 g/mol, XLogP of -1.19, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-tert-butyl-2-(2-hydroxyethylsulfonylamino)acetamide is sourced from PubChem (CID 115356606), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).