2-(4-fluorophenyl)sulfonylcyclobutan-1-amine

C10H12FNO2S — CID 134203404

IUPAC2-(4-fluorophenyl)sulfonylcyclobutan-1-amine
SMILESNC1CCC1S(=O)(=O)c1ccc(F)cc1
InChIInChI=1S/C10H12FNO2S/c11-7-1-3-8(4-2-7)15(13,14)10-6-5-9(10)12/h1-4,9-10H,5-6,12H2
InChIKeyQEDNUGTZGIVQFV-UHFFFAOYSA-N
MW229.28 g/mol
LogP1.09
Rot. Bonds2

About 2-(4-fluorophenyl)sulfonylcyclobutan-1-amine

2-(4-fluorophenyl)sulfonylcyclobutan-1-amine (PubChem CID 134203404) has the molecular formula C10H12FNO2S and a molecular weight of 229.28 g/mol. Its IUPAC name is 2-(4-fluorophenyl)sulfonylcyclobutan-1-amine.

Molecular Properties

Compound Name2-(4-fluorophenyl)sulfonylcyclobutan-1-amine
PubChem CID134203404
Molecular FormulaC10H12FNO2S
Molecular Weight229.28 g/mol
Exact Mass229.06
IUPAC Name2-(4-fluorophenyl)sulfonylcyclobutan-1-amine
SMILESNC1CCC1S(=O)(=O)c1ccc(F)cc1
InChIInChI=1S/C10H12FNO2S/c11-7-1-3-8(4-2-7)15(13,14)10-6-5-9(10)12/h1-4,9-10H,5-6,12H2
InChIKeyQEDNUGTZGIVQFV-UHFFFAOYSA-N
XLogP1.09
TPSA60.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.28
LogP ≤ 51.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(4-fluorophenyl)sulfonylcyclobutan-1-amine?
The IUPAC name of 2-(4-fluorophenyl)sulfonylcyclobutan-1-amine (CID 134203404) is 2-(4-fluorophenyl)sulfonylcyclobutan-1-amine.
What is the SMILES notation for 2-(4-fluorophenyl)sulfonylcyclobutan-1-amine?
The canonical SMILES for 2-(4-fluorophenyl)sulfonylcyclobutan-1-amine is NC1CCC1S(=O)(=O)c1ccc(F)cc1.
What is the InChIKey of 2-(4-fluorophenyl)sulfonylcyclobutan-1-amine?
The InChIKey is QEDNUGTZGIVQFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12FNO2S/c11-7-1-3-8(4-2-7)15(13,14)10-6-5-9(10)12/h1-4,9-10H,5-6,12H2.
What are the key properties of 2-(4-fluorophenyl)sulfonylcyclobutan-1-amine?
2-(4-fluorophenyl)sulfonylcyclobutan-1-amine has a molecular weight of 229.28 g/mol, XLogP of 1.09, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-fluorophenyl)sulfonylcyclobutan-1-amine is sourced from PubChem (CID 134203404), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).