N-[(2-fluorophenyl)methylsulfamoyl]-1-phenylmethanamine

C14H15FN2O2S — CID 1475421

IUPACN-[(2-fluorophenyl)methylsulfamoyl]-1-phenylmethanamine
SMILESO=S(=O)(NCc1ccccc1)NCc1ccccc1F
InChIInChI=1S/C14H15FN2O2S/c15-14-9-5-4-8-13(14)11-17-20(18,19)16-10-12-6-2-1-3-7-12/h1-9,16-17H,10-11H2
InChIKeyOWUJRSPSYCVIJG-UHFFFAOYSA-N
MW294.35 g/mol
LogP1.95
Rot. Bonds6

About N-[(2-fluorophenyl)methylsulfamoyl]-1-phenylmethanamine

N-[(2-fluorophenyl)methylsulfamoyl]-1-phenylmethanamine (PubChem CID 1475421) has the molecular formula C14H15FN2O2S and a molecular weight of 294.35 g/mol. Its IUPAC name is N-[(2-fluorophenyl)methylsulfamoyl]-1-phenylmethanamine.

Molecular Properties

Compound NameN-[(2-fluorophenyl)methylsulfamoyl]-1-phenylmethanamine
PubChem CID1475421
Molecular FormulaC14H15FN2O2S
Molecular Weight294.35 g/mol
Exact Mass294.08
IUPAC NameN-[(2-fluorophenyl)methylsulfamoyl]-1-phenylmethanamine
SMILESO=S(=O)(NCc1ccccc1)NCc1ccccc1F
InChIInChI=1S/C14H15FN2O2S/c15-14-9-5-4-8-13(14)11-17-20(18,19)16-10-12-6-2-1-3-7-12/h1-9,16-17H,10-11H2
InChIKeyOWUJRSPSYCVIJG-UHFFFAOYSA-N
XLogP1.95
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.35
LogP ≤ 51.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-[(2-fluorophenyl)methylsulfamoyl]-1-phenylmethanamine?
The IUPAC name of N-[(2-fluorophenyl)methylsulfamoyl]-1-phenylmethanamine (CID 1475421) is N-[(2-fluorophenyl)methylsulfamoyl]-1-phenylmethanamine.
What is the SMILES notation for N-[(2-fluorophenyl)methylsulfamoyl]-1-phenylmethanamine?
The canonical SMILES for N-[(2-fluorophenyl)methylsulfamoyl]-1-phenylmethanamine is O=S(=O)(NCc1ccccc1)NCc1ccccc1F.
What is the InChIKey of N-[(2-fluorophenyl)methylsulfamoyl]-1-phenylmethanamine?
The InChIKey is OWUJRSPSYCVIJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15FN2O2S/c15-14-9-5-4-8-13(14)11-17-20(18,19)16-10-12-6-2-1-3-7-12/h1-9,16-17H,10-11H2.
What are the key properties of N-[(2-fluorophenyl)methylsulfamoyl]-1-phenylmethanamine?
N-[(2-fluorophenyl)methylsulfamoyl]-1-phenylmethanamine has a molecular weight of 294.35 g/mol, XLogP of 1.95, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-fluorophenyl)methylsulfamoyl]-1-phenylmethanamine is sourced from PubChem (CID 1475421), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).