N-(3,3-diphenylpropyl)ethanesulfonamide

C17H21NO2S — CID 843314

IUPACN-(3,3-diphenylpropyl)ethanesulfonamide
SMILESCCS(=O)(=O)NCCC(c1ccccc1)c1ccccc1
InChIInChI=1S/C17H21NO2S/c1-2-21(19,20)18-14-13-17(15-9-5-3-6-10-15)16-11-7-4-8-12-16/h3-12,17-18H,2,13-14H2,1H3
InChIKeyCRPNIGWYNHPMFV-UHFFFAOYSA-N
MW303.43 g/mol
LogP3.15
Rot. Bonds7

About N-(3,3-diphenylpropyl)ethanesulfonamide

N-(3,3-diphenylpropyl)ethanesulfonamide (PubChem CID 843314) has the molecular formula C17H21NO2S and a molecular weight of 303.43 g/mol. Its IUPAC name is N-(3,3-diphenylpropyl)ethanesulfonamide.

Molecular Properties

Compound NameN-(3,3-diphenylpropyl)ethanesulfonamide
PubChem CID843314
Molecular FormulaC17H21NO2S
Molecular Weight303.43 g/mol
Exact Mass303.13
IUPAC NameN-(3,3-diphenylpropyl)ethanesulfonamide
SMILESCCS(=O)(=O)NCCC(c1ccccc1)c1ccccc1
InChIInChI=1S/C17H21NO2S/c1-2-21(19,20)18-14-13-17(15-9-5-3-6-10-15)16-11-7-4-8-12-16/h3-12,17-18H,2,13-14H2,1H3
InChIKeyCRPNIGWYNHPMFV-UHFFFAOYSA-N
XLogP3.15
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.43
LogP ≤ 53.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(3,3-diphenylpropyl)ethanesulfonamide?
The IUPAC name of N-(3,3-diphenylpropyl)ethanesulfonamide (CID 843314) is N-(3,3-diphenylpropyl)ethanesulfonamide.
What is the SMILES notation for N-(3,3-diphenylpropyl)ethanesulfonamide?
The canonical SMILES for N-(3,3-diphenylpropyl)ethanesulfonamide is CCS(=O)(=O)NCCC(c1ccccc1)c1ccccc1.
What is the InChIKey of N-(3,3-diphenylpropyl)ethanesulfonamide?
The InChIKey is CRPNIGWYNHPMFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21NO2S/c1-2-21(19,20)18-14-13-17(15-9-5-3-6-10-15)16-11-7-4-8-12-16/h3-12,17-18H,2,13-14H2,1H3.
What are the key properties of N-(3,3-diphenylpropyl)ethanesulfonamide?
N-(3,3-diphenylpropyl)ethanesulfonamide has a molecular weight of 303.43 g/mol, XLogP of 3.15, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,3-diphenylpropyl)ethanesulfonamide is sourced from PubChem (CID 843314), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).