2-(3,3-dimethylbutylsulfonylamino)acetamide

C8H18N2O3S — CID 103521045

IUPAC2-(3,3-dimethylbutylsulfonylamino)acetamide
SMILESCC(C)(C)CCS(=O)(=O)NCC(N)=O
InChIInChI=1S/C8H18N2O3S/c1-8(2,3)4-5-14(12,13)10-6-7(9)11/h10H,4-6H2,1-3H3,(H2,9,11)
InChIKeyFCNNYNJJDCHPRY-UHFFFAOYSA-N
MW222.31 g/mol
LogP-0.17
Rot. Bonds5

About 2-(3,3-dimethylbutylsulfonylamino)acetamide

2-(3,3-dimethylbutylsulfonylamino)acetamide (PubChem CID 103521045) has the molecular formula C8H18N2O3S and a molecular weight of 222.31 g/mol. Its IUPAC name is 2-(3,3-dimethylbutylsulfonylamino)acetamide.

Molecular Properties

Compound Name2-(3,3-dimethylbutylsulfonylamino)acetamide
PubChem CID103521045
Molecular FormulaC8H18N2O3S
Molecular Weight222.31 g/mol
Exact Mass222.10
IUPAC Name2-(3,3-dimethylbutylsulfonylamino)acetamide
SMILESCC(C)(C)CCS(=O)(=O)NCC(N)=O
InChIInChI=1S/C8H18N2O3S/c1-8(2,3)4-5-14(12,13)10-6-7(9)11/h10H,4-6H2,1-3H3,(H2,9,11)
InChIKeyFCNNYNJJDCHPRY-UHFFFAOYSA-N
XLogP-0.17
TPSA89.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.31
LogP ≤ 5-0.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(3R)-3-aminobutyl]-3,3-dimethylbutane-1-sulfonamide
CID 100655614
N-(3-aminopropyl)-3,3-dimethylbutane-1-sulfonamide
CID 103828845
N-(4-amino-2,2-dimethylbutyl)-3,3-dimethylbutane-1-sulfonamide
CID 106141530
N-(3-hydroxypentyl)-3,3-dimethylbutane-1-sulfonamide
CID 71848189
N-(2-ethyl-2-hydroxybutyl)-3,3-dimethylbutane-1-sulfonamide
CID 103684499
N-(5-aminopentyl)-3,3-dimethylbutane-1-sulfonamide
CID 103520785
N-(2-hydroxy-4,4-dimethylpentyl)-3,3-dimethylbutane-1-sulfonamide
CID 113240024
N-(2-amino-3-methylbutyl)-3,3-dimethylbutane-1-sulfonamide
CID 103829022
N-(2-amino-3-ethylpentyl)-3,3-dimethylbutane-1-sulfonamide
CID 106286721
N-[(2-hydroxycyclopentyl)methyl]-3,3-dimethylbutane-1-sulfonamide
CID 103697972
N-[2-(2-bromoethoxy)ethyl]-3,3-dimethylbutane-1-sulfonamide
CID 103521791
N-[(2-hydroxyphenyl)methyl]-3,3-dimethylbutane-1-sulfonamide
CID 113240012

Frequently Asked Questions

What is the IUPAC name of 2-(3,3-dimethylbutylsulfonylamino)acetamide?
The IUPAC name of 2-(3,3-dimethylbutylsulfonylamino)acetamide (CID 103521045) is 2-(3,3-dimethylbutylsulfonylamino)acetamide.
What is the SMILES notation for 2-(3,3-dimethylbutylsulfonylamino)acetamide?
The canonical SMILES for 2-(3,3-dimethylbutylsulfonylamino)acetamide is CC(C)(C)CCS(=O)(=O)NCC(N)=O.
What is the InChIKey of 2-(3,3-dimethylbutylsulfonylamino)acetamide?
The InChIKey is FCNNYNJJDCHPRY-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18N2O3S/c1-8(2,3)4-5-14(12,13)10-6-7(9)11/h10H,4-6H2,1-3H3,(H2,9,11).
What are the key properties of 2-(3,3-dimethylbutylsulfonylamino)acetamide?
2-(3,3-dimethylbutylsulfonylamino)acetamide has a molecular weight of 222.31 g/mol, XLogP of -0.17, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,3-dimethylbutylsulfonylamino)acetamide is sourced from PubChem (CID 103521045), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).