3-amino-N-(2,2-dimethylcyclopentyl)propane-1-sulfonamide

C10H22N2O2S — CID 79871135

IUPAC3-amino-N-(2,2-dimethylcyclopentyl)propane-1-sulfonamide
SMILESCC1(C)CCCC1NS(=O)(=O)CCCN
InChIInChI=1S/C10H22N2O2S/c1-10(2)6-3-5-9(10)12-15(13,14)8-4-7-11/h9,12H,3-8,11H2,1-2H3
InChIKeyILGIMWPLPUZDGY-UHFFFAOYSA-N
MW234.36 g/mol
LogP0.83
Rot. Bonds5

About 3-amino-N-(2,2-dimethylcyclopentyl)propane-1-sulfonamide

3-amino-N-(2,2-dimethylcyclopentyl)propane-1-sulfonamide (PubChem CID 79871135) has the molecular formula C10H22N2O2S and a molecular weight of 234.36 g/mol. Its IUPAC name is 3-amino-N-(2,2-dimethylcyclopentyl)propane-1-sulfonamide.

Molecular Properties

Compound Name3-amino-N-(2,2-dimethylcyclopentyl)propane-1-sulfonamide
PubChem CID79871135
Molecular FormulaC10H22N2O2S
Molecular Weight234.36 g/mol
Exact Mass234.14
IUPAC Name3-amino-N-(2,2-dimethylcyclopentyl)propane-1-sulfonamide
SMILESCC1(C)CCCC1NS(=O)(=O)CCCN
InChIInChI=1S/C10H22N2O2S/c1-10(2)6-3-5-9(10)12-15(13,14)8-4-7-11/h9,12H,3-8,11H2,1-2H3
InChIKeyILGIMWPLPUZDGY-UHFFFAOYSA-N
XLogP0.83
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.36
LogP ≤ 50.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-amino-N-(2,2-dimethylcyclopentyl)propane-1-sulfonamide?
The IUPAC name of 3-amino-N-(2,2-dimethylcyclopentyl)propane-1-sulfonamide (CID 79871135) is 3-amino-N-(2,2-dimethylcyclopentyl)propane-1-sulfonamide.
What is the SMILES notation for 3-amino-N-(2,2-dimethylcyclopentyl)propane-1-sulfonamide?
The canonical SMILES for 3-amino-N-(2,2-dimethylcyclopentyl)propane-1-sulfonamide is CC1(C)CCCC1NS(=O)(=O)CCCN.
What is the InChIKey of 3-amino-N-(2,2-dimethylcyclopentyl)propane-1-sulfonamide?
The InChIKey is ILGIMWPLPUZDGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2O2S/c1-10(2)6-3-5-9(10)12-15(13,14)8-4-7-11/h9,12H,3-8,11H2,1-2H3.
What are the key properties of 3-amino-N-(2,2-dimethylcyclopentyl)propane-1-sulfonamide?
3-amino-N-(2,2-dimethylcyclopentyl)propane-1-sulfonamide has a molecular weight of 234.36 g/mol, XLogP of 0.83, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-(2,2-dimethylcyclopentyl)propane-1-sulfonamide is sourced from PubChem (CID 79871135), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).