N-(benzylsulfamoyl)-1-phenylmethanamine

C14H16N2O2S — CID 1488548

IUPACN-(benzylsulfamoyl)-1-phenylmethanamine
SMILESO=S(=O)(NCc1ccccc1)NCc1ccccc1
InChIInChI=1S/C14H16N2O2S/c17-19(18,15-11-13-7-3-1-4-8-13)16-12-14-9-5-2-6-10-14/h1-10,15-16H,11-12H2
InChIKeyPURCZXCDZQICPW-UHFFFAOYSA-N
MW276.36 g/mol
LogP1.81
Rot. Bonds6

About N-(benzylsulfamoyl)-1-phenylmethanamine

N-(benzylsulfamoyl)-1-phenylmethanamine (PubChem CID 1488548) has the molecular formula C14H16N2O2S and a molecular weight of 276.36 g/mol. Its IUPAC name is N-(benzylsulfamoyl)-1-phenylmethanamine.

Molecular Properties

Compound NameN-(benzylsulfamoyl)-1-phenylmethanamine
PubChem CID1488548
Molecular FormulaC14H16N2O2S
Molecular Weight276.36 g/mol
Exact Mass276.09
IUPAC NameN-(benzylsulfamoyl)-1-phenylmethanamine
SMILESO=S(=O)(NCc1ccccc1)NCc1ccccc1
InChIInChI=1S/C14H16N2O2S/c17-19(18,15-11-13-7-3-1-4-8-13)16-12-14-9-5-2-6-10-14/h1-10,15-16H,11-12H2
InChIKeyPURCZXCDZQICPW-UHFFFAOYSA-N
XLogP1.81
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.36
LogP ≤ 51.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(benzylsulfamoyl)-1-phenylmethanamine?
The IUPAC name of N-(benzylsulfamoyl)-1-phenylmethanamine (CID 1488548) is N-(benzylsulfamoyl)-1-phenylmethanamine.
What is the SMILES notation for N-(benzylsulfamoyl)-1-phenylmethanamine?
The canonical SMILES for N-(benzylsulfamoyl)-1-phenylmethanamine is O=S(=O)(NCc1ccccc1)NCc1ccccc1.
What is the InChIKey of N-(benzylsulfamoyl)-1-phenylmethanamine?
The InChIKey is PURCZXCDZQICPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O2S/c17-19(18,15-11-13-7-3-1-4-8-13)16-12-14-9-5-2-6-10-14/h1-10,15-16H,11-12H2.
What are the key properties of N-(benzylsulfamoyl)-1-phenylmethanamine?
N-(benzylsulfamoyl)-1-phenylmethanamine has a molecular weight of 276.36 g/mol, XLogP of 1.81, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(benzylsulfamoyl)-1-phenylmethanamine is sourced from PubChem (CID 1488548), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).