N-(2,2-dimethylpropyl)pyrrolidine-1-sulfonamide

C9H20N2O2S — CID 130218587

IUPACN-(2,2-dimethylpropyl)pyrrolidine-1-sulfonamide
SMILESCC(C)(C)CNS(=O)(=O)N1CCCC1
InChIInChI=1S/C9H20N2O2S/c1-9(2,3)8-10-14(12,13)11-6-4-5-7-11/h10H,4-8H2,1-3H3
InChIKeyQCQKMNFTIRUQCT-UHFFFAOYSA-N
MW220.34 g/mol
LogP0.96
Rot. Bonds3

About N-(2,2-dimethylpropyl)pyrrolidine-1-sulfonamide

N-(2,2-dimethylpropyl)pyrrolidine-1-sulfonamide (PubChem CID 130218587) has the molecular formula C9H20N2O2S and a molecular weight of 220.34 g/mol. Its IUPAC name is N-(2,2-dimethylpropyl)pyrrolidine-1-sulfonamide.

Molecular Properties

Compound NameN-(2,2-dimethylpropyl)pyrrolidine-1-sulfonamide
PubChem CID130218587
Molecular FormulaC9H20N2O2S
Molecular Weight220.34 g/mol
Exact Mass220.12
IUPAC NameN-(2,2-dimethylpropyl)pyrrolidine-1-sulfonamide
SMILESCC(C)(C)CNS(=O)(=O)N1CCCC1
InChIInChI=1S/C9H20N2O2S/c1-9(2,3)8-10-14(12,13)11-6-4-5-7-11/h10H,4-8H2,1-3H3
InChIKeyQCQKMNFTIRUQCT-UHFFFAOYSA-N
XLogP0.96
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.34
LogP ≤ 50.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(2,2-dimethylpropyl)pyrrolidine-1-sulfonamide?
The IUPAC name of N-(2,2-dimethylpropyl)pyrrolidine-1-sulfonamide (CID 130218587) is N-(2,2-dimethylpropyl)pyrrolidine-1-sulfonamide.
What is the SMILES notation for N-(2,2-dimethylpropyl)pyrrolidine-1-sulfonamide?
The canonical SMILES for N-(2,2-dimethylpropyl)pyrrolidine-1-sulfonamide is CC(C)(C)CNS(=O)(=O)N1CCCC1.
What is the InChIKey of N-(2,2-dimethylpropyl)pyrrolidine-1-sulfonamide?
The InChIKey is QCQKMNFTIRUQCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20N2O2S/c1-9(2,3)8-10-14(12,13)11-6-4-5-7-11/h10H,4-8H2,1-3H3.
What are the key properties of N-(2,2-dimethylpropyl)pyrrolidine-1-sulfonamide?
N-(2,2-dimethylpropyl)pyrrolidine-1-sulfonamide has a molecular weight of 220.34 g/mol, XLogP of 0.96, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,2-dimethylpropyl)pyrrolidine-1-sulfonamide is sourced from PubChem (CID 130218587), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).