N-(2-amino-1-cyclopentylethyl)-1,1-difluoromethanesulfonamide

C8H16F2N2O2S — CID 106737846

IUPACN-(2-amino-1-cyclopentylethyl)-1,1-difluoromethanesulfonamide
SMILESNCC(NS(=O)(=O)C(F)F)C1CCCC1
InChIInChI=1S/C8H16F2N2O2S/c9-8(10)15(13,14)12-7(5-11)6-3-1-2-4-6/h6-8,12H,1-5,11H2
InChIKeyGPOGPKOFFANRNQ-UHFFFAOYSA-N
MW242.29 g/mol
LogP0.65
Rot. Bonds5

About N-(2-amino-1-cyclopentylethyl)-1,1-difluoromethanesulfonamide

N-(2-amino-1-cyclopentylethyl)-1,1-difluoromethanesulfonamide (PubChem CID 106737846) has the molecular formula C8H16F2N2O2S and a molecular weight of 242.29 g/mol. Its IUPAC name is N-(2-amino-1-cyclopentylethyl)-1,1-difluoromethanesulfonamide.

Molecular Properties

Compound NameN-(2-amino-1-cyclopentylethyl)-1,1-difluoromethanesulfonamide
PubChem CID106737846
Molecular FormulaC8H16F2N2O2S
Molecular Weight242.29 g/mol
Exact Mass242.09
IUPAC NameN-(2-amino-1-cyclopentylethyl)-1,1-difluoromethanesulfonamide
SMILESNCC(NS(=O)(=O)C(F)F)C1CCCC1
InChIInChI=1S/C8H16F2N2O2S/c9-8(10)15(13,14)12-7(5-11)6-3-1-2-4-6/h6-8,12H,1-5,11H2
InChIKeyGPOGPKOFFANRNQ-UHFFFAOYSA-N
XLogP0.65
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.29
LogP ≤ 50.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-[1-(aminomethyl)cyclopentyl]ethyl]-1,1,1-trifluoromethanesulfonamide
CID 21888413
3,3,3-trifluoro-N-[(1R,3S)-3-methylcyclopentyl]propane-1-sulfonamide
CID 68316105
N-(6-amino-2-ethylheptyl)-1,1,1-trifluoromethanesulfonamide
CID 121432266
1-(2-Amino-4,4-difluorocyclopentyl)-2-methylpropane-2-sulfonamide
CID 142797226
N-[1-(aminomethyl)cyclohexyl]-1,1-difluoromethanesulfonamide
CID 28940488
N-[1-(aminomethyl)cyclopentyl]-1,1-difluoromethanesulfonamide
CID 28940526
N-[(1-aminocyclohexyl)methyl]-1,1-difluoromethanesulfonamide
CID 43598224
N-(2-amino-4-methylpentyl)-1,1-difluoromethanesulfonamide
CID 43606286
N-(2-amino-1-cyclohexylethyl)-1,1-difluoromethanesulfonamide
CID 61124961
N-[2-(aminomethyl)cyclopentyl]-1,1-difluoromethanesulfonamide
CID 62955345
N-(1-amino-4-methylpentan-2-yl)-1,1-difluoromethanesulfonamide
CID 63767726
N-[1-(aminomethyl)cyclopentyl]-1,1,1-trifluoromethanesulfonamide
CID 63886823

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-1-cyclopentylethyl)-1,1-difluoromethanesulfonamide?
The IUPAC name of N-(2-amino-1-cyclopentylethyl)-1,1-difluoromethanesulfonamide (CID 106737846) is N-(2-amino-1-cyclopentylethyl)-1,1-difluoromethanesulfonamide.
What is the SMILES notation for N-(2-amino-1-cyclopentylethyl)-1,1-difluoromethanesulfonamide?
The canonical SMILES for N-(2-amino-1-cyclopentylethyl)-1,1-difluoromethanesulfonamide is NCC(NS(=O)(=O)C(F)F)C1CCCC1.
What is the InChIKey of N-(2-amino-1-cyclopentylethyl)-1,1-difluoromethanesulfonamide?
The InChIKey is GPOGPKOFFANRNQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16F2N2O2S/c9-8(10)15(13,14)12-7(5-11)6-3-1-2-4-6/h6-8,12H,1-5,11H2.
What are the key properties of N-(2-amino-1-cyclopentylethyl)-1,1-difluoromethanesulfonamide?
N-(2-amino-1-cyclopentylethyl)-1,1-difluoromethanesulfonamide has a molecular weight of 242.29 g/mol, XLogP of 0.65, 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)-1,1-difluoromethanesulfonamide is sourced from PubChem (CID 106737846), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).