4-amino-4-(2-fluorophenyl)-N-methyloxolane-3-sulfonamide

C11H15FN2O3S — CID 70855567

IUPAC4-amino-4-(2-fluorophenyl)-N-methyloxolane-3-sulfonamide
SMILESCNS(=O)(=O)C1COCC1(N)c1ccccc1F
InChIInChI=1S/C11H15FN2O3S/c1-14-18(15,16)10-6-17-7-11(10,13)8-4-2-3-5-9(8)12/h2-5,10,14H,6-7,13H2,1H3
InChIKeyLHJCXBYACUPUEF-UHFFFAOYSA-N
MW274.32 g/mol
LogP-0.07
Rot. Bonds3

About 4-amino-4-(2-fluorophenyl)-N-methyloxolane-3-sulfonamide

4-amino-4-(2-fluorophenyl)-N-methyloxolane-3-sulfonamide (PubChem CID 70855567) has the molecular formula C11H15FN2O3S and a molecular weight of 274.32 g/mol. Its IUPAC name is 4-amino-4-(2-fluorophenyl)-N-methyloxolane-3-sulfonamide.

Molecular Properties

Compound Name4-amino-4-(2-fluorophenyl)-N-methyloxolane-3-sulfonamide
PubChem CID70855567
Molecular FormulaC11H15FN2O3S
Molecular Weight274.32 g/mol
Exact Mass274.08
IUPAC Name4-amino-4-(2-fluorophenyl)-N-methyloxolane-3-sulfonamide
SMILESCNS(=O)(=O)C1COCC1(N)c1ccccc1F
InChIInChI=1S/C11H15FN2O3S/c1-14-18(15,16)10-6-17-7-11(10,13)8-4-2-3-5-9(8)12/h2-5,10,14H,6-7,13H2,1H3
InChIKeyLHJCXBYACUPUEF-UHFFFAOYSA-N
XLogP-0.07
TPSA81.42 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.32
LogP ≤ 5-0.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-amino-4-(2-fluorophenyl)-N-methyloxolane-3-sulfonamide?
The IUPAC name of 4-amino-4-(2-fluorophenyl)-N-methyloxolane-3-sulfonamide (CID 70855567) is 4-amino-4-(2-fluorophenyl)-N-methyloxolane-3-sulfonamide.
What is the SMILES notation for 4-amino-4-(2-fluorophenyl)-N-methyloxolane-3-sulfonamide?
The canonical SMILES for 4-amino-4-(2-fluorophenyl)-N-methyloxolane-3-sulfonamide is CNS(=O)(=O)C1COCC1(N)c1ccccc1F.
What is the InChIKey of 4-amino-4-(2-fluorophenyl)-N-methyloxolane-3-sulfonamide?
The InChIKey is LHJCXBYACUPUEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15FN2O3S/c1-14-18(15,16)10-6-17-7-11(10,13)8-4-2-3-5-9(8)12/h2-5,10,14H,6-7,13H2,1H3.
What are the key properties of 4-amino-4-(2-fluorophenyl)-N-methyloxolane-3-sulfonamide?
4-amino-4-(2-fluorophenyl)-N-methyloxolane-3-sulfonamide has a molecular weight of 274.32 g/mol, XLogP of -0.07, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-4-(2-fluorophenyl)-N-methyloxolane-3-sulfonamide is sourced from PubChem (CID 70855567), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).