2-(2-aminoethylsulfonylamino)-N-propan-2-ylacetamide

C7H17N3O3S — CID 43567968

IUPAC2-(2-aminoethylsulfonylamino)-N-propan-2-ylacetamide
SMILESCC(C)NC(=O)CNS(=O)(=O)CCN
InChIInChI=1S/C7H17N3O3S/c1-6(2)10-7(11)5-9-14(12,13)4-3-8/h6,9H,3-5,8H2,1-2H3,(H,10,11)
InChIKeyYHTRFNBWVVASDM-UHFFFAOYSA-N
MW223.30 g/mol
LogP-1.61
Rot. Bonds6

About 2-(2-aminoethylsulfonylamino)-N-propan-2-ylacetamide

2-(2-aminoethylsulfonylamino)-N-propan-2-ylacetamide (PubChem CID 43567968) has the molecular formula C7H17N3O3S and a molecular weight of 223.30 g/mol. Its IUPAC name is 2-(2-aminoethylsulfonylamino)-N-propan-2-ylacetamide.

Molecular Properties

Compound Name2-(2-aminoethylsulfonylamino)-N-propan-2-ylacetamide
PubChem CID43567968
Molecular FormulaC7H17N3O3S
Molecular Weight223.30 g/mol
Exact Mass223.10
IUPAC Name2-(2-aminoethylsulfonylamino)-N-propan-2-ylacetamide
SMILESCC(C)NC(=O)CNS(=O)(=O)CCN
InChIInChI=1S/C7H17N3O3S/c1-6(2)10-7(11)5-9-14(12,13)4-3-8/h6,9H,3-5,8H2,1-2H3,(H,10,11)
InChIKeyYHTRFNBWVVASDM-UHFFFAOYSA-N
XLogP-1.61
TPSA101.29 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.30
LogP ≤ 5-1.61
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-propan-2-yl-2-(sulfamoylamino)acetamide
CID 112684221
N-propan-2-yl-2-(propan-2-ylsulfonylamino)acetamide
CID 47371491
2-[(5-amino-2-fluorophenyl)sulfonylamino]-N-propan-2-ylacetamide
CID 43567667
4-[[3-[[2-oxo-2-(propan-2-ylamino)ethyl]sulfamoyl]propanoylamino]methyl]benzoic acid
CID 119353533
2-[(3-amino-4-fluoro-2,6-dimethylphenyl)sulfonylamino]-N-propan-2-ylacetamide
CID 107325645
1-[3-[[2-oxo-2-(propan-2-ylamino)ethyl]sulfamoyl]propanoyl]pyrrolidine-2-carboxylic acid
CID 119356885
2-[(2-amino-5-bromo-4-fluorophenyl)sulfonylamino]-N-propan-2-ylacetamide
CID 106491434
1-[3-[[2-oxo-2-(propan-2-ylamino)ethyl]sulfamoyl]propanoyl]pyrrolidine-3-carboxylic acid
CID 119355189
3-[[2-oxo-2-(propan-2-ylamino)ethyl]sulfamoyl]-N-(pyrrolidin-2-ylmethyl)propanamide;hydrochloride
CID 119513490
(2S)-2-[[2-(2-propan-2-yloxyethylsulfonylamino)acetyl]amino]propanoic acid
CID 119238322
2-[(2-amino-3-pyridinyl)sulfonylamino]-N-propan-2-ylacetamide
CID 62146480
2-[(5-amino-2-ethylphenyl)sulfonylamino]-N-propan-2-ylacetamide
CID 43567663

Frequently Asked Questions

What is the IUPAC name of 2-(2-aminoethylsulfonylamino)-N-propan-2-ylacetamide?
The IUPAC name of 2-(2-aminoethylsulfonylamino)-N-propan-2-ylacetamide (CID 43567968) is 2-(2-aminoethylsulfonylamino)-N-propan-2-ylacetamide.
What is the SMILES notation for 2-(2-aminoethylsulfonylamino)-N-propan-2-ylacetamide?
The canonical SMILES for 2-(2-aminoethylsulfonylamino)-N-propan-2-ylacetamide is CC(C)NC(=O)CNS(=O)(=O)CCN.
What is the InChIKey of 2-(2-aminoethylsulfonylamino)-N-propan-2-ylacetamide?
The InChIKey is YHTRFNBWVVASDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H17N3O3S/c1-6(2)10-7(11)5-9-14(12,13)4-3-8/h6,9H,3-5,8H2,1-2H3,(H,10,11).
What are the key properties of 2-(2-aminoethylsulfonylamino)-N-propan-2-ylacetamide?
2-(2-aminoethylsulfonylamino)-N-propan-2-ylacetamide has a molecular weight of 223.30 g/mol, XLogP of -1.61, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-aminoethylsulfonylamino)-N-propan-2-ylacetamide is sourced from PubChem (CID 43567968), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).