N-[(1R,2S)-2-fluorocyclopentyl]propane-2-sulfonamide

C8H16FNO2S — CID 130678047

IUPACN-[(1R,2S)-2-fluorocyclopentyl]propane-2-sulfonamide
SMILESCC(C)S(=O)(=O)N[C@@H]1CCC[C@@H]1F
InChIInChI=1S/C8H16FNO2S/c1-6(2)13(11,12)10-8-5-3-4-7(8)9/h6-8,10H,3-5H2,1-2H3/t7-,8+/m0/s1
InChIKeyMDSKMTDKJMAFFS-JGVFFNPUSA-N
MW209.29 g/mol
LogP1.20
Rot. Bonds3

About N-[(1R,2S)-2-fluorocyclopentyl]propane-2-sulfonamide

N-[(1R,2S)-2-fluorocyclopentyl]propane-2-sulfonamide (PubChem CID 130678047) has the molecular formula C8H16FNO2S and a molecular weight of 209.29 g/mol. Its IUPAC name is N-[(1R,2S)-2-fluorocyclopentyl]propane-2-sulfonamide.

Molecular Properties

Compound NameN-[(1R,2S)-2-fluorocyclopentyl]propane-2-sulfonamide
PubChem CID130678047
Molecular FormulaC8H16FNO2S
Molecular Weight209.29 g/mol
Exact Mass209.09
IUPAC NameN-[(1R,2S)-2-fluorocyclopentyl]propane-2-sulfonamide
SMILESCC(C)S(=O)(=O)N[C@@H]1CCC[C@@H]1F
InChIInChI=1S/C8H16FNO2S/c1-6(2)13(11,12)10-8-5-3-4-7(8)9/h6-8,10H,3-5H2,1-2H3/t7-,8+/m0/s1
InChIKeyMDSKMTDKJMAFFS-JGVFFNPUSA-N
XLogP1.20
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.29
LogP ≤ 51.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 303123
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CID 129397177
N-(3-aminopentyl)-3,3,3-trifluoropropane-1-sulfonamide
CID 123840797
N-cyclohexyl-1-fluoroethanesulfonamide
CID 123992888
N-[(1R)-3,3-difluorocyclopentyl]-2-methylpropane-2-sulfonamide
CID 163825829
Fluoro-pentyl-propylsulfonylazanium
CID 173613030
N-[(3S)-3-fluorobutan-2-yl]propane-1-sulfonamide
CID 173808830
N-[(2R)-3-fluorobutan-2-yl]propane-1-sulfonamide
CID 173983735
N-cyclopentyl-4,4,4-trifluorobutane-1-sulfonamide
CID 82903856
N-(2-aminocyclopentyl)-4,4,4-trifluorobutane-1-sulfonamide
CID 83059574

Frequently Asked Questions

What is the IUPAC name of N-[(1R,2S)-2-fluorocyclopentyl]propane-2-sulfonamide?
The IUPAC name of N-[(1R,2S)-2-fluorocyclopentyl]propane-2-sulfonamide (CID 130678047) is N-[(1R,2S)-2-fluorocyclopentyl]propane-2-sulfonamide.
What is the SMILES notation for N-[(1R,2S)-2-fluorocyclopentyl]propane-2-sulfonamide?
The canonical SMILES for N-[(1R,2S)-2-fluorocyclopentyl]propane-2-sulfonamide is CC(C)S(=O)(=O)N[C@@H]1CCC[C@@H]1F.
What is the InChIKey of N-[(1R,2S)-2-fluorocyclopentyl]propane-2-sulfonamide?
The InChIKey is MDSKMTDKJMAFFS-JGVFFNPUSA-N. The full InChI is InChI=1S/C8H16FNO2S/c1-6(2)13(11,12)10-8-5-3-4-7(8)9/h6-8,10H,3-5H2,1-2H3/t7-,8+/m0/s1.
What are the key properties of N-[(1R,2S)-2-fluorocyclopentyl]propane-2-sulfonamide?
N-[(1R,2S)-2-fluorocyclopentyl]propane-2-sulfonamide has a molecular weight of 209.29 g/mol, XLogP of 1.20, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1R,2S)-2-fluorocyclopentyl]propane-2-sulfonamide is sourced from PubChem (CID 130678047), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).