N-tert-butyl-2-[(2-methyl-2-methylsulfonylpropyl)amino]acetamide

C11H24N2O3S — CID 79551841

IUPACN-tert-butyl-2-[(2-methyl-2-methylsulfonylpropyl)amino]acetamide
SMILESCC(C)(C)NC(=O)CNCC(C)(C)S(C)(=O)=O
InChIInChI=1S/C11H24N2O3S/c1-10(2,3)13-9(14)7-12-8-11(4,5)17(6,15)16/h12H,7-8H2,1-6H3,(H,13,14)
InChIKeyGEBSLRVVXFAFKW-UHFFFAOYSA-N
MW264.39 g/mol
LogP0.31
Rot. Bonds5

About N-tert-butyl-2-[(2-methyl-2-methylsulfonylpropyl)amino]acetamide

N-tert-butyl-2-[(2-methyl-2-methylsulfonylpropyl)amino]acetamide (PubChem CID 79551841) has the molecular formula C11H24N2O3S and a molecular weight of 264.39 g/mol. Its IUPAC name is N-tert-butyl-2-[(2-methyl-2-methylsulfonylpropyl)amino]acetamide.

Molecular Properties

Compound NameN-tert-butyl-2-[(2-methyl-2-methylsulfonylpropyl)amino]acetamide
PubChem CID79551841
Molecular FormulaC11H24N2O3S
Molecular Weight264.39 g/mol
Exact Mass264.15
IUPAC NameN-tert-butyl-2-[(2-methyl-2-methylsulfonylpropyl)amino]acetamide
SMILESCC(C)(C)NC(=O)CNCC(C)(C)S(C)(=O)=O
InChIInChI=1S/C11H24N2O3S/c1-10(2,3)13-9(14)7-12-8-11(4,5)17(6,15)16/h12H,7-8H2,1-6H3,(H,13,14)
InChIKeyGEBSLRVVXFAFKW-UHFFFAOYSA-N
XLogP0.31
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.39
LogP ≤ 50.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-cyclopentyl-2-[(2-methyl-2-methylsulfonylpropyl)amino]acetamide
CID 79552375
N-tert-butyl-2-(2-ethylsulfonylethylamino)acetamide
CID 115356498
N-tert-butyl-2-[(4-hydroxy-2,2-dimethylbutyl)amino]acetamide
CID 106146940
N,N-diethyl-2-[(2-methyl-2-methylsulfonylpropyl)amino]acetamide
CID 79552369
2-methyl-4-[(2-methyl-2-methylsulfonylpropyl)amino]butan-2-ol
CID 79551403
N-(2-methyl-2-methylsulfonylpropyl)piperidine-1-carboxamide
CID 115675126
2-[[[2-(tert-butylamino)-2-oxoethyl]amino]methyl]prop-2-enoic acid
CID 103260235
N-(2-methyl-2-methylsulfonylpropyl)-3-sulfanylpropanamide
CID 107032221
2-methyl-4-[(2-methyl-2-methylsulfonylpropyl)amino]but-2-enoic acid
CID 103256247
N-tert-butyl-2-(2-hydroxybutylamino)acetamide
CID 115356599
2-[[2-(tert-butylamino)-2-oxoethyl]amino]-N-(cyanomethyl)acetamide
CID 115356626
N-tert-butyl-2-(2-hydroxyethylsulfonylamino)acetamide
CID 115356606

Frequently Asked Questions

What is the IUPAC name of N-tert-butyl-2-[(2-methyl-2-methylsulfonylpropyl)amino]acetamide?
The IUPAC name of N-tert-butyl-2-[(2-methyl-2-methylsulfonylpropyl)amino]acetamide (CID 79551841) is N-tert-butyl-2-[(2-methyl-2-methylsulfonylpropyl)amino]acetamide.
What is the SMILES notation for N-tert-butyl-2-[(2-methyl-2-methylsulfonylpropyl)amino]acetamide?
The canonical SMILES for N-tert-butyl-2-[(2-methyl-2-methylsulfonylpropyl)amino]acetamide is CC(C)(C)NC(=O)CNCC(C)(C)S(C)(=O)=O.
What is the InChIKey of N-tert-butyl-2-[(2-methyl-2-methylsulfonylpropyl)amino]acetamide?
The InChIKey is GEBSLRVVXFAFKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O3S/c1-10(2,3)13-9(14)7-12-8-11(4,5)17(6,15)16/h12H,7-8H2,1-6H3,(H,13,14).
What are the key properties of N-tert-butyl-2-[(2-methyl-2-methylsulfonylpropyl)amino]acetamide?
N-tert-butyl-2-[(2-methyl-2-methylsulfonylpropyl)amino]acetamide has a molecular weight of 264.39 g/mol, XLogP of 0.31, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-tert-butyl-2-[(2-methyl-2-methylsulfonylpropyl)amino]acetamide is sourced from PubChem (CID 79551841), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).