N-benzyl-1-phenylmethanesulfonamide

C14H15NO2S — CID 669277

IUPACN-benzyl-1-phenylmethanesulfonamide
SMILESO=S(=O)(Cc1ccccc1)NCc1ccccc1
InChIInChI=1S/C14H15NO2S/c16-18(17,12-14-9-5-2-6-10-14)15-11-13-7-3-1-4-8-13/h1-10,15H,11-12H2
InChIKeyFYRBPJQSGABSBF-UHFFFAOYSA-N
MW261.35 g/mol
LogP2.31
Rot. Bonds5

About N-benzyl-1-phenylmethanesulfonamide

N-benzyl-1-phenylmethanesulfonamide (PubChem CID 669277) has the molecular formula C14H15NO2S and a molecular weight of 261.35 g/mol. Its IUPAC name is N-benzyl-1-phenylmethanesulfonamide.

Molecular Properties

Compound NameN-benzyl-1-phenylmethanesulfonamide
PubChem CID669277
Molecular FormulaC14H15NO2S
Molecular Weight261.35 g/mol
Exact Mass261.08
IUPAC NameN-benzyl-1-phenylmethanesulfonamide
SMILESO=S(=O)(Cc1ccccc1)NCc1ccccc1
InChIInChI=1S/C14H15NO2S/c16-18(17,12-14-9-5-2-6-10-14)15-11-13-7-3-1-4-8-13/h1-10,15H,11-12H2
InChIKeyFYRBPJQSGABSBF-UHFFFAOYSA-N
XLogP2.31
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.35
LogP ≤ 52.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-benzyl-1-phenylmethanesulfonamide?
The IUPAC name of N-benzyl-1-phenylmethanesulfonamide (CID 669277) is N-benzyl-1-phenylmethanesulfonamide.
What is the SMILES notation for N-benzyl-1-phenylmethanesulfonamide?
The canonical SMILES for N-benzyl-1-phenylmethanesulfonamide is O=S(=O)(Cc1ccccc1)NCc1ccccc1.
What is the InChIKey of N-benzyl-1-phenylmethanesulfonamide?
The InChIKey is FYRBPJQSGABSBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15NO2S/c16-18(17,12-14-9-5-2-6-10-14)15-11-13-7-3-1-4-8-13/h1-10,15H,11-12H2.
What are the key properties of N-benzyl-1-phenylmethanesulfonamide?
N-benzyl-1-phenylmethanesulfonamide has a molecular weight of 261.35 g/mol, XLogP of 2.31, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-1-phenylmethanesulfonamide is sourced from PubChem (CID 669277), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).