N-(3-amino-2,2-dimethylpropyl)cyclobutanesulfonamide

C9H20N2O2S — CID 115270992

IUPACN-(3-amino-2,2-dimethylpropyl)cyclobutanesulfonamide
SMILESCC(C)(CN)CNS(=O)(=O)C1CCC1
InChIInChI=1S/C9H20N2O2S/c1-9(2,6-10)7-11-14(12,13)8-4-3-5-8/h8,11H,3-7,10H2,1-2H3
InChIKeyMJZIIBUEZCLWDF-UHFFFAOYSA-N
MW220.34 g/mol
LogP0.44
Rot. Bonds5

About N-(3-amino-2,2-dimethylpropyl)cyclobutanesulfonamide

N-(3-amino-2,2-dimethylpropyl)cyclobutanesulfonamide (PubChem CID 115270992) has the molecular formula C9H20N2O2S and a molecular weight of 220.34 g/mol. Its IUPAC name is N-(3-amino-2,2-dimethylpropyl)cyclobutanesulfonamide.

Molecular Properties

Compound NameN-(3-amino-2,2-dimethylpropyl)cyclobutanesulfonamide
PubChem CID115270992
Molecular FormulaC9H20N2O2S
Molecular Weight220.34 g/mol
Exact Mass220.12
IUPAC NameN-(3-amino-2,2-dimethylpropyl)cyclobutanesulfonamide
SMILESCC(C)(CN)CNS(=O)(=O)C1CCC1
InChIInChI=1S/C9H20N2O2S/c1-9(2,6-10)7-11-14(12,13)8-4-3-5-8/h8,11H,3-7,10H2,1-2H3
InChIKeyMJZIIBUEZCLWDF-UHFFFAOYSA-N
XLogP0.44
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.34
LogP ≤ 50.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(3-amino-2,2-dimethylpropyl)cyclobutanesulfonamide?
The IUPAC name of N-(3-amino-2,2-dimethylpropyl)cyclobutanesulfonamide (CID 115270992) is N-(3-amino-2,2-dimethylpropyl)cyclobutanesulfonamide.
What is the SMILES notation for N-(3-amino-2,2-dimethylpropyl)cyclobutanesulfonamide?
The canonical SMILES for N-(3-amino-2,2-dimethylpropyl)cyclobutanesulfonamide is CC(C)(CN)CNS(=O)(=O)C1CCC1.
What is the InChIKey of N-(3-amino-2,2-dimethylpropyl)cyclobutanesulfonamide?
The InChIKey is MJZIIBUEZCLWDF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20N2O2S/c1-9(2,6-10)7-11-14(12,13)8-4-3-5-8/h8,11H,3-7,10H2,1-2H3.
What are the key properties of N-(3-amino-2,2-dimethylpropyl)cyclobutanesulfonamide?
N-(3-amino-2,2-dimethylpropyl)cyclobutanesulfonamide has a molecular weight of 220.34 g/mol, XLogP of 0.44, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-amino-2,2-dimethylpropyl)cyclobutanesulfonamide is sourced from PubChem (CID 115270992), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).