N-cyclopentyl-1,1-difluoromethanesulfonamide

C6H11F2NO2S — CID 62732375

IUPACN-cyclopentyl-1,1-difluoromethanesulfonamide
SMILESO=S(=O)(NC1CCCC1)C(F)F
InChIInChI=1S/C6H11F2NO2S/c7-6(8)12(10,11)9-5-3-1-2-4-5/h5-6,9H,1-4H2
InChIKeyAEXOZSLRGICKRE-UHFFFAOYSA-N
MW199.22 g/mol
LogP1.07
Rot. Bonds3

About N-cyclopentyl-1,1-difluoromethanesulfonamide

N-cyclopentyl-1,1-difluoromethanesulfonamide (PubChem CID 62732375) has the molecular formula C6H11F2NO2S and a molecular weight of 199.22 g/mol. Its IUPAC name is N-cyclopentyl-1,1-difluoromethanesulfonamide.

Molecular Properties

Compound NameN-cyclopentyl-1,1-difluoromethanesulfonamide
PubChem CID62732375
Molecular FormulaC6H11F2NO2S
Molecular Weight199.22 g/mol
Exact Mass199.05
IUPAC NameN-cyclopentyl-1,1-difluoromethanesulfonamide
SMILESO=S(=O)(NC1CCCC1)C(F)F
InChIInChI=1S/C6H11F2NO2S/c7-6(8)12(10,11)9-5-3-1-2-4-5/h5-6,9H,1-4H2
InChIKeyAEXOZSLRGICKRE-UHFFFAOYSA-N
XLogP1.07
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.22
LogP ≤ 51.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-cyclopentylmethanesulfonamide
CID 799038
N-Cyclohexyltrifluoromethanesulfonamide
CID 14965464
N-(4,4-difluorocyclohexyl)methanesulfonamide
CID 57747898
1,1,1-trifluoro-N-hexan-3-ylmethanesulfonamide
CID 166446328
N-Cyclopentyltrifluoromethanesulfonamide
CID 14076853
N-[(1S,2S)-2-aminocyclopentyl]-1,1,1-trifluoromethanesulfonamide
CID 67439421
1,1,1-trifluoro-N-pentan-2-ylmethanesulfonamide
CID 87844438
1,1-difluoro-N-pentylmethanesulfonamide
CID 88766737
N-cyclopentyl-1,1,2,2,3,3,3-heptafluoropropane-1-sulfonamide
CID 129294963
N-cyclopentyl-1,1,2,2,2-pentafluoroethanesulfonamide
CID 129294967
N-cyclopentyl-1,1,2,2,3,3,4,4,4-nonafluorobutane-1-sulfonamide
CID 129294972
(3,3-Difluorocyclopentyl)sulfamic acid
CID 146839726

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-1,1-difluoromethanesulfonamide?
The IUPAC name of N-cyclopentyl-1,1-difluoromethanesulfonamide (CID 62732375) is N-cyclopentyl-1,1-difluoromethanesulfonamide.
What is the SMILES notation for N-cyclopentyl-1,1-difluoromethanesulfonamide?
The canonical SMILES for N-cyclopentyl-1,1-difluoromethanesulfonamide is O=S(=O)(NC1CCCC1)C(F)F.
What is the InChIKey of N-cyclopentyl-1,1-difluoromethanesulfonamide?
The InChIKey is AEXOZSLRGICKRE-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11F2NO2S/c7-6(8)12(10,11)9-5-3-1-2-4-5/h5-6,9H,1-4H2.
What are the key properties of N-cyclopentyl-1,1-difluoromethanesulfonamide?
N-cyclopentyl-1,1-difluoromethanesulfonamide has a molecular weight of 199.22 g/mol, XLogP of 1.07, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-1,1-difluoromethanesulfonamide is sourced from PubChem (CID 62732375), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).