diphenylmethanesulfonamide

C13H13NO2S — CID 22298989

IUPACdiphenylmethanesulfonamide
SMILESNS(=O)(=O)C(c1ccccc1)c1ccccc1
InChIInChI=1S/C13H13NO2S/c14-17(15,16)13(11-7-3-1-4-8-11)12-9-5-2-6-10-12/h1-10,13H,(H2,14,15,16)
InChIKeyDPYKEYXMUFFQAI-UHFFFAOYSA-N
MW247.32 g/mol
LogP2.06
Rot. Bonds3

About diphenylmethanesulfonamide

diphenylmethanesulfonamide (PubChem CID 22298989) has the molecular formula C13H13NO2S and a molecular weight of 247.32 g/mol. Its IUPAC name is diphenylmethanesulfonamide.

Molecular Properties

Compound Namediphenylmethanesulfonamide
PubChem CID22298989
Molecular FormulaC13H13NO2S
Molecular Weight247.32 g/mol
Exact Mass247.07
IUPAC Namediphenylmethanesulfonamide
SMILESNS(=O)(=O)C(c1ccccc1)c1ccccc1
InChIInChI=1S/C13H13NO2S/c14-17(15,16)13(11-7-3-1-4-8-11)12-9-5-2-6-10-12/h1-10,13H,(H2,14,15,16)
InChIKeyDPYKEYXMUFFQAI-UHFFFAOYSA-N
XLogP2.06
TPSA60.16 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.32
LogP ≤ 52.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of diphenylmethanesulfonamide?
The IUPAC name of diphenylmethanesulfonamide (CID 22298989) is diphenylmethanesulfonamide.
What is the SMILES notation for diphenylmethanesulfonamide?
The canonical SMILES for diphenylmethanesulfonamide is NS(=O)(=O)C(c1ccccc1)c1ccccc1.
What is the InChIKey of diphenylmethanesulfonamide?
The InChIKey is DPYKEYXMUFFQAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13NO2S/c14-17(15,16)13(11-7-3-1-4-8-11)12-9-5-2-6-10-12/h1-10,13H,(H2,14,15,16).
What are the key properties of diphenylmethanesulfonamide?
diphenylmethanesulfonamide has a molecular weight of 247.32 g/mol, XLogP of 2.06, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for diphenylmethanesulfonamide is sourced from PubChem (CID 22298989), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).