N-(2-amino-1-cyclopentylethyl)ethanesulfonamide

C9H20N2O2S — CID 106737875

IUPACN-(2-amino-1-cyclopentylethyl)ethanesulfonamide
SMILESCCS(=O)(=O)NC(CN)C1CCCC1
InChIInChI=1S/C9H20N2O2S/c1-2-14(12,13)11-9(7-10)8-5-3-4-6-8/h8-9,11H,2-7,10H2,1H3
InChIKeyZAFILSRZVCUIFU-UHFFFAOYSA-N
MW220.34 g/mol
LogP0.44
Rot. Bonds5

About N-(2-amino-1-cyclopentylethyl)ethanesulfonamide

N-(2-amino-1-cyclopentylethyl)ethanesulfonamide (PubChem CID 106737875) has the molecular formula C9H20N2O2S and a molecular weight of 220.34 g/mol. Its IUPAC name is N-(2-amino-1-cyclopentylethyl)ethanesulfonamide.

Molecular Properties

Compound NameN-(2-amino-1-cyclopentylethyl)ethanesulfonamide
PubChem CID106737875
Molecular FormulaC9H20N2O2S
Molecular Weight220.34 g/mol
Exact Mass220.12
IUPAC NameN-(2-amino-1-cyclopentylethyl)ethanesulfonamide
SMILESCCS(=O)(=O)NC(CN)C1CCCC1
InChIInChI=1S/C9H20N2O2S/c1-2-14(12,13)11-9(7-10)8-5-3-4-6-8/h8-9,11H,2-7,10H2,1H3
InChIKeyZAFILSRZVCUIFU-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-(2-amino-1-cyclopentylethyl)ethanesulfonamide?
The IUPAC name of N-(2-amino-1-cyclopentylethyl)ethanesulfonamide (CID 106737875) is N-(2-amino-1-cyclopentylethyl)ethanesulfonamide.
What is the SMILES notation for N-(2-amino-1-cyclopentylethyl)ethanesulfonamide?
The canonical SMILES for N-(2-amino-1-cyclopentylethyl)ethanesulfonamide is CCS(=O)(=O)NC(CN)C1CCCC1.
What is the InChIKey of N-(2-amino-1-cyclopentylethyl)ethanesulfonamide?
The InChIKey is ZAFILSRZVCUIFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20N2O2S/c1-2-14(12,13)11-9(7-10)8-5-3-4-6-8/h8-9,11H,2-7,10H2,1H3.
What are the key properties of N-(2-amino-1-cyclopentylethyl)ethanesulfonamide?
N-(2-amino-1-cyclopentylethyl)ethanesulfonamide 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-(2-amino-1-cyclopentylethyl)ethanesulfonamide is sourced from PubChem (CID 106737875), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).