(E)-N-[(6-methoxynaphthalen-2-yl)methyl]-2-phenylethenesulfonamide

C20H19NO3S — CID 46696275

IUPAC(E)-N-[(6-methoxynaphthalen-2-yl)methyl]-2-phenylethenesulfonamide
SMILESCOc1ccc2cc(CNS(=O)(=O)/C=C/c3ccccc3)ccc2c1
InChIInChI=1S/C20H19NO3S/c1-24-20-10-9-18-13-17(7-8-19(18)14-20)15-21-25(22,23)12-11-16-5-3-2-4-6-16/h2-14,21H,15H2,1H3/b12-11+
InChIKeyALRKMQWHMYBAIH-VAWYXSNFSA-N
MW353.44 g/mol
LogP3.94
Rot. Bonds6

About (E)-N-[(6-methoxynaphthalen-2-yl)methyl]-2-phenylethenesulfonamide

(E)-N-[(6-methoxynaphthalen-2-yl)methyl]-2-phenylethenesulfonamide (PubChem CID 46696275) has the molecular formula C20H19NO3S and a molecular weight of 353.44 g/mol. Its IUPAC name is (E)-N-[(6-methoxynaphthalen-2-yl)methyl]-2-phenylethenesulfonamide.

Molecular Properties

Compound Name(E)-N-[(6-methoxynaphthalen-2-yl)methyl]-2-phenylethenesulfonamide
PubChem CID46696275
Molecular FormulaC20H19NO3S
Molecular Weight353.44 g/mol
Exact Mass353.11
IUPAC Name(E)-N-[(6-methoxynaphthalen-2-yl)methyl]-2-phenylethenesulfonamide
SMILESCOc1ccc2cc(CNS(=O)(=O)/C=C/c3ccccc3)ccc2c1
InChIInChI=1S/C20H19NO3S/c1-24-20-10-9-18-13-17(7-8-19(18)14-20)15-21-25(22,23)12-11-16-5-3-2-4-6-16/h2-14,21H,15H2,1H3/b12-11+
InChIKeyALRKMQWHMYBAIH-VAWYXSNFSA-N
XLogP3.94
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.44
LogP ≤ 53.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze (E)-N-[(6-methoxynaphthalen-2-yl)methyl]-2-phenylethenesulfonamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(E)-N-[(3-methoxy-4-phenylmethoxyphenyl)methyl]-2-phenylethenesulfonamide
CID 8802776
(E)-N-[[4-(difluoromethoxy)-3-methoxyphenyl]methyl]-2-phenylethenesulfonamide
CID 9189230
(E)-N-(4-methoxyphenyl)-2-phenylethenesulfonamide
CID 767425
N-[(6-methoxynaphthalen-2-yl)methyl]propane-2-sulfonamide
CID 47371751
(E)-N-[[3-[2-(dimethylamino)ethoxy]phenyl]methyl]-2-phenylethenesulfonamide
CID 60530963
N-[(6-methoxynaphthalen-2-yl)methyl]-1-phenylmethanamine
CID 18505307
3-N-[(6-methoxynaphthalen-2-yl)methyl]benzene-1,3-disulfonamide
CID 31109957
(E)-N-[2-(dimethylamino)-2-(3-methoxyphenyl)ethyl]-2-phenylethenesulfonamide
CID 51169691
N-[(4-methoxyphenyl)methylsulfamoyl]-1-phenylmethanamine
CID 1475423
(E)-N-ethyl-2-phenylethenesulfonamide
CID 43212835
3-chloro-N-[(6-methoxynaphthalen-2-yl)methyl]benzenesulfonamide
CID 46696278
2-[4-[(4-fluorophenyl)methoxy]-3-methoxyphenyl]-N-[(3-methoxyphenyl)methyl]ethenesulfonamide
CID 1487527

Frequently Asked Questions

What is the IUPAC name of (E)-N-[(6-methoxynaphthalen-2-yl)methyl]-2-phenylethenesulfonamide?
The IUPAC name of (E)-N-[(6-methoxynaphthalen-2-yl)methyl]-2-phenylethenesulfonamide (CID 46696275) is (E)-N-[(6-methoxynaphthalen-2-yl)methyl]-2-phenylethenesulfonamide.
What is the SMILES notation for (E)-N-[(6-methoxynaphthalen-2-yl)methyl]-2-phenylethenesulfonamide?
The canonical SMILES for (E)-N-[(6-methoxynaphthalen-2-yl)methyl]-2-phenylethenesulfonamide is COc1ccc2cc(CNS(=O)(=O)/C=C/c3ccccc3)ccc2c1.
What is the InChIKey of (E)-N-[(6-methoxynaphthalen-2-yl)methyl]-2-phenylethenesulfonamide?
The InChIKey is ALRKMQWHMYBAIH-VAWYXSNFSA-N. The full InChI is InChI=1S/C20H19NO3S/c1-24-20-10-9-18-13-17(7-8-19(18)14-20)15-21-25(22,23)12-11-16-5-3-2-4-6-16/h2-14,21H,15H2,1H3/b12-11+.
What are the key properties of (E)-N-[(6-methoxynaphthalen-2-yl)methyl]-2-phenylethenesulfonamide?
(E)-N-[(6-methoxynaphthalen-2-yl)methyl]-2-phenylethenesulfonamide has a molecular weight of 353.44 g/mol, XLogP of 3.94, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-N-[(6-methoxynaphthalen-2-yl)methyl]-2-phenylethenesulfonamide is sourced from PubChem (CID 46696275), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).