N-(2-phenyl-3-pyridin-2-ylpropyl)benzenesulfonamide

C20H20N2O2S — CID 110361170

IUPACN-(2-phenyl-3-pyridin-2-ylpropyl)benzenesulfonamide
SMILESO=S(=O)(NCC(Cc1ccccn1)c1ccccc1)c1ccccc1
InChIInChI=1S/C20H20N2O2S/c23-25(24,20-12-5-2-6-13-20)22-16-18(17-9-3-1-4-10-17)15-19-11-7-8-14-21-19/h1-14,18,22H,15-16H2
InChIKeyZABGSCYPUJUYLR-UHFFFAOYSA-N
MW352.46 g/mol
LogP3.39
Rot. Bonds7

About N-(2-phenyl-3-pyridin-2-ylpropyl)benzenesulfonamide

N-(2-phenyl-3-pyridin-2-ylpropyl)benzenesulfonamide (PubChem CID 110361170) has the molecular formula C20H20N2O2S and a molecular weight of 352.46 g/mol. Its IUPAC name is N-(2-phenyl-3-pyridin-2-ylpropyl)benzenesulfonamide.

Molecular Properties

Compound NameN-(2-phenyl-3-pyridin-2-ylpropyl)benzenesulfonamide
PubChem CID110361170
Molecular FormulaC20H20N2O2S
Molecular Weight352.46 g/mol
Exact Mass352.12
IUPAC NameN-(2-phenyl-3-pyridin-2-ylpropyl)benzenesulfonamide
SMILESO=S(=O)(NCC(Cc1ccccn1)c1ccccc1)c1ccccc1
InChIInChI=1S/C20H20N2O2S/c23-25(24,20-12-5-2-6-13-20)22-16-18(17-9-3-1-4-10-17)15-19-11-7-8-14-21-19/h1-14,18,22H,15-16H2
InChIKeyZABGSCYPUJUYLR-UHFFFAOYSA-N
XLogP3.39
TPSA59.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.46
LogP ≤ 53.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2,2-diphenylethyl)pyridine-2-sulfonamide
CID 135085971
N-[2-phenyl-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl]benzenesulfonamide
CID 23604903
4-methyl-N-(pyridin-2-ylmethyl)benzenesulfonamide
CID 731623
4-amino-N-(pyridin-2-ylmethyl)benzenesulfonamide
CID 3663787
N-[(2S)-2-(benzhydrylamino)-2-phenylethyl]benzenesulfonamide
CID 1230083
[1-(3-methylsulfonylphenyl)-2-pyridin-2-ylethyl]hydrazine
CID 105315250
N-(1-phenyl-2-pyridin-2-ylethyl)formamide
CID 57000523
(1-phenyl-2-pyridin-2-ylethyl)carbamic acid
CID 134541861
2-[[(1,4-dimethylpyrazol-5-yl)sulfonylamino]methyl]-3-pyridin-2-ylpropanoic acid
CID 136541721
N-[2-(methylamino)propyl]benzenesulfonamide
CID 103512552
2-methylsulfonyl-1-phenyl-N-(pyridin-2-ylmethyl)ethanamine
CID 75443632
3-amino-N-(pyridin-2-ylmethyl)benzenesulfonamide
CID 16795667

Frequently Asked Questions

What is the IUPAC name of N-(2-phenyl-3-pyridin-2-ylpropyl)benzenesulfonamide?
The IUPAC name of N-(2-phenyl-3-pyridin-2-ylpropyl)benzenesulfonamide (CID 110361170) is N-(2-phenyl-3-pyridin-2-ylpropyl)benzenesulfonamide.
What is the SMILES notation for N-(2-phenyl-3-pyridin-2-ylpropyl)benzenesulfonamide?
The canonical SMILES for N-(2-phenyl-3-pyridin-2-ylpropyl)benzenesulfonamide is O=S(=O)(NCC(Cc1ccccn1)c1ccccc1)c1ccccc1.
What is the InChIKey of N-(2-phenyl-3-pyridin-2-ylpropyl)benzenesulfonamide?
The InChIKey is ZABGSCYPUJUYLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20N2O2S/c23-25(24,20-12-5-2-6-13-20)22-16-18(17-9-3-1-4-10-17)15-19-11-7-8-14-21-19/h1-14,18,22H,15-16H2.
What are the key properties of N-(2-phenyl-3-pyridin-2-ylpropyl)benzenesulfonamide?
N-(2-phenyl-3-pyridin-2-ylpropyl)benzenesulfonamide has a molecular weight of 352.46 g/mol, XLogP of 3.39, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-phenyl-3-pyridin-2-ylpropyl)benzenesulfonamide is sourced from PubChem (CID 110361170), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).