(E)-2-phenyl-N-[3-(pyridin-2-ylmethoxy)phenyl]ethenesulfonamide

C20H18N2O3S — CID 43069636

IUPAC(E)-2-phenyl-N-[3-(pyridin-2-ylmethoxy)phenyl]ethenesulfonamide
SMILESO=S(=O)(/C=C/c1ccccc1)Nc1cccc(OCc2ccccn2)c1
InChIInChI=1S/C20H18N2O3S/c23-26(24,14-12-17-7-2-1-3-8-17)22-18-10-6-11-20(15-18)25-16-19-9-4-5-13-21-19/h1-15,22H,16H2/b14-12+
InChIKeyDBHHZVPHCQVEGB-WYMLVPIESA-N
MW366.44 g/mol
LogP4.07
Rot. Bonds7

About (E)-2-phenyl-N-[3-(pyridin-2-ylmethoxy)phenyl]ethenesulfonamide

(E)-2-phenyl-N-[3-(pyridin-2-ylmethoxy)phenyl]ethenesulfonamide (PubChem CID 43069636) has the molecular formula C20H18N2O3S and a molecular weight of 366.44 g/mol. Its IUPAC name is (E)-2-phenyl-N-[3-(pyridin-2-ylmethoxy)phenyl]ethenesulfonamide.

Molecular Properties

Compound Name(E)-2-phenyl-N-[3-(pyridin-2-ylmethoxy)phenyl]ethenesulfonamide
PubChem CID43069636
Molecular FormulaC20H18N2O3S
Molecular Weight366.44 g/mol
Exact Mass366.10
IUPAC Name(E)-2-phenyl-N-[3-(pyridin-2-ylmethoxy)phenyl]ethenesulfonamide
SMILESO=S(=O)(/C=C/c1ccccc1)Nc1cccc(OCc2ccccn2)c1
InChIInChI=1S/C20H18N2O3S/c23-26(24,14-12-17-7-2-1-3-8-17)22-18-10-6-11-20(15-18)25-16-19-9-4-5-13-21-19/h1-15,22H,16H2/b14-12+
InChIKeyDBHHZVPHCQVEGB-WYMLVPIESA-N
XLogP4.07
TPSA68.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.44
LogP ≤ 54.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-methylsulfonyl-N-[3-(pyridin-2-ylmethoxy)phenyl]benzenesulfonamide
CID 55645155
4-[[3-(pyridin-2-ylmethoxy)phenyl]sulfamoyl]benzoic acid
CID 55645126
2,3-dichloro-N-[3-(pyridin-2-ylmethoxy)phenyl]benzenesulfonamide
CID 43069625
N-[3-(pyridin-2-ylmethoxy)phenyl]thiophene-2-sulfonamide
CID 39839792
N-[3-(pyridin-2-ylmethoxy)phenyl]-4-(trifluoromethoxy)benzenesulfonamide
CID 43069660
3,4-dimethoxy-N-[3-(pyridin-2-ylmethoxy)phenyl]benzenesulfonamide
CID 43069653
(E)-N-(3-cyclopentyloxyphenyl)-2-phenylethenesulfonamide
CID 35547764
2-[benzenesulfonyl(methyl)amino]-N-[3-(pyridin-2-ylmethoxy)phenyl]acetamide
CID 38667056
2-[[3-(2-nitroethenyl)phenoxy]methyl]pyridine
CID 66707738
2-chloro-N-[3-(pyridin-2-ylmethoxy)phenyl]-5-(trifluoromethyl)benzenesulfonamide
CID 43069632
(NZ)-N-[[3-(pyridin-2-ylmethoxy)phenyl]methylidene]hydroxylamine
CID 29021936
4-phenyl-N-[3-(pyridin-2-ylmethoxy)phenyl]benzamide
CID 38670554

Frequently Asked Questions

What is the IUPAC name of (E)-2-phenyl-N-[3-(pyridin-2-ylmethoxy)phenyl]ethenesulfonamide?
The IUPAC name of (E)-2-phenyl-N-[3-(pyridin-2-ylmethoxy)phenyl]ethenesulfonamide (CID 43069636) is (E)-2-phenyl-N-[3-(pyridin-2-ylmethoxy)phenyl]ethenesulfonamide.
What is the SMILES notation for (E)-2-phenyl-N-[3-(pyridin-2-ylmethoxy)phenyl]ethenesulfonamide?
The canonical SMILES for (E)-2-phenyl-N-[3-(pyridin-2-ylmethoxy)phenyl]ethenesulfonamide is O=S(=O)(/C=C/c1ccccc1)Nc1cccc(OCc2ccccn2)c1.
What is the InChIKey of (E)-2-phenyl-N-[3-(pyridin-2-ylmethoxy)phenyl]ethenesulfonamide?
The InChIKey is DBHHZVPHCQVEGB-WYMLVPIESA-N. The full InChI is InChI=1S/C20H18N2O3S/c23-26(24,14-12-17-7-2-1-3-8-17)22-18-10-6-11-20(15-18)25-16-19-9-4-5-13-21-19/h1-15,22H,16H2/b14-12+.
What are the key properties of (E)-2-phenyl-N-[3-(pyridin-2-ylmethoxy)phenyl]ethenesulfonamide?
(E)-2-phenyl-N-[3-(pyridin-2-ylmethoxy)phenyl]ethenesulfonamide has a molecular weight of 366.44 g/mol, XLogP of 4.07, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-2-phenyl-N-[3-(pyridin-2-ylmethoxy)phenyl]ethenesulfonamide is sourced from PubChem (CID 43069636), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).