2-(2-amino-2-methylpropyl)sulfonyl-N-tert-butylacetamide

C10H22N2O3S — CID 81188442

IUPAC2-(2-amino-2-methylpropyl)sulfonyl-N-tert-butylacetamide
SMILESCC(C)(N)CS(=O)(=O)CC(=O)NC(C)(C)C
InChIInChI=1S/C10H22N2O3S/c1-9(2,3)12-8(13)6-16(14,15)7-10(4,5)11/h6-7,11H2,1-5H3,(H,12,13)
InChIKeyFMYSEHJNNMDWKD-UHFFFAOYSA-N
MW250.36 g/mol
LogP0.05
Rot. Bonds4

About 2-(2-amino-2-methylpropyl)sulfonyl-N-tert-butylacetamide

2-(2-amino-2-methylpropyl)sulfonyl-N-tert-butylacetamide (PubChem CID 81188442) has the molecular formula C10H22N2O3S and a molecular weight of 250.36 g/mol. Its IUPAC name is 2-(2-amino-2-methylpropyl)sulfonyl-N-tert-butylacetamide.

Molecular Properties

Compound Name2-(2-amino-2-methylpropyl)sulfonyl-N-tert-butylacetamide
PubChem CID81188442
Molecular FormulaC10H22N2O3S
Molecular Weight250.36 g/mol
Exact Mass250.14
IUPAC Name2-(2-amino-2-methylpropyl)sulfonyl-N-tert-butylacetamide
SMILESCC(C)(N)CS(=O)(=O)CC(=O)NC(C)(C)C
InChIInChI=1S/C10H22N2O3S/c1-9(2,3)12-8(13)6-16(14,15)7-10(4,5)11/h6-7,11H2,1-5H3,(H,12,13)
InChIKeyFMYSEHJNNMDWKD-UHFFFAOYSA-N
XLogP0.05
TPSA89.26 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.36
LogP ≤ 50.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(2-amino-2-methylpropyl)sulfonyl-N-tert-butylacetamide?
The IUPAC name of 2-(2-amino-2-methylpropyl)sulfonyl-N-tert-butylacetamide (CID 81188442) is 2-(2-amino-2-methylpropyl)sulfonyl-N-tert-butylacetamide.
What is the SMILES notation for 2-(2-amino-2-methylpropyl)sulfonyl-N-tert-butylacetamide?
The canonical SMILES for 2-(2-amino-2-methylpropyl)sulfonyl-N-tert-butylacetamide is CC(C)(N)CS(=O)(=O)CC(=O)NC(C)(C)C.
What is the InChIKey of 2-(2-amino-2-methylpropyl)sulfonyl-N-tert-butylacetamide?
The InChIKey is FMYSEHJNNMDWKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2O3S/c1-9(2,3)12-8(13)6-16(14,15)7-10(4,5)11/h6-7,11H2,1-5H3,(H,12,13).
What are the key properties of 2-(2-amino-2-methylpropyl)sulfonyl-N-tert-butylacetamide?
2-(2-amino-2-methylpropyl)sulfonyl-N-tert-butylacetamide has a molecular weight of 250.36 g/mol, XLogP of 0.05, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-amino-2-methylpropyl)sulfonyl-N-tert-butylacetamide is sourced from PubChem (CID 81188442), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).