N,N-dimethyl-2-[5-[2-(2-phenylethenylsulfonylamino)ethyl]naphthalen-1-yl]oxyacetamide

C24H26N2O4S — CID 54193107

IUPACN,N-dimethyl-2-[5-[2-(2-phenylethenylsulfonylamino)ethyl]naphthalen-1-yl]oxyacetamide
SMILESCN(C)C(=O)COc1cccc2c(CCNS(=O)(=O)C=Cc3ccccc3)cccc12
InChIInChI=1S/C24H26N2O4S/c1-26(2)24(27)18-30-23-13-7-11-21-20(10-6-12-22(21)23)14-16-25-31(28,29)17-15-19-8-4-3-5-9-19/h3-13,15,17,25H,14,16,18H2,1-2H3
InChIKeyPJWMZCOSVVTOEE-UHFFFAOYSA-N
MW438.55 g/mol
LogP3.44
Rot. Bonds9

About N,N-dimethyl-2-[5-[2-(2-phenylethenylsulfonylamino)ethyl]naphthalen-1-yl]oxyacetamide

N,N-dimethyl-2-[5-[2-(2-phenylethenylsulfonylamino)ethyl]naphthalen-1-yl]oxyacetamide (PubChem CID 54193107) has the molecular formula C24H26N2O4S and a molecular weight of 438.55 g/mol. Its IUPAC name is N,N-dimethyl-2-[5-[2-(2-phenylethenylsulfonylamino)ethyl]naphthalen-1-yl]oxyacetamide.

Molecular Properties

Compound NameN,N-dimethyl-2-[5-[2-(2-phenylethenylsulfonylamino)ethyl]naphthalen-1-yl]oxyacetamide
PubChem CID54193107
Molecular FormulaC24H26N2O4S
Molecular Weight438.55 g/mol
Exact Mass438.16
IUPAC NameN,N-dimethyl-2-[5-[2-(2-phenylethenylsulfonylamino)ethyl]naphthalen-1-yl]oxyacetamide
SMILESCN(C)C(=O)COc1cccc2c(CCNS(=O)(=O)C=Cc3ccccc3)cccc12
InChIInChI=1S/C24H26N2O4S/c1-26(2)24(27)18-30-23-13-7-11-21-20(10-6-12-22(21)23)14-16-25-31(28,29)17-15-19-8-4-3-5-9-19/h3-13,15,17,25H,14,16,18H2,1-2H3
InChIKeyPJWMZCOSVVTOEE-UHFFFAOYSA-N
XLogP3.44
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500438.55
LogP ≤ 53.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N,N-dimethyl-2-[5-[2-(2-phenylethenylsulfonylamino)ethyl]naphthalen-1-yl]oxyacetamide 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

2-[5-[2-[[(E)-2-(4-methoxyphenyl)ethenyl]sulfonylamino]ethyl]naphthalen-1-yl]oxyacetic acid
CID 19694546
2-[2-[5-(carboxymethoxy)naphthalen-1-yl]ethyl-(2-phenylethenylsulfonyl)amino]acetic acid
CID 54429524
2-[[5-[2-[[(E)-2-phenylethenyl]sulfonylamino]ethyl]-7,8-dihydronaphthalen-1-yl]oxy]acetic acid
CID 19694559
2-[5-[2-(2-phenylpropylsulfonylamino)ethyl]naphthalen-1-yl]oxyacetic acid
CID 19694541
[2-(dimethylamino)-2-oxoethyl] (2S)-2-[[(E)-2-phenylethenyl]sulfonylamino]propanoate
CID 8849270
2-(2-methylphenoxy)ethyl 3-[[(E)-2-phenylethenyl]sulfonylamino]propanoate
CID 7827992
ethyl (E)-3-[4-[2-(2-phenylethenylsulfonylamino)ethyl]phenyl]prop-2-enoate
CID 70513692
(E)-N-(2-aminoethyl)-2-phenylethenesulfonamide
CID 43603519
(E)-N-ethyl-2-phenylethenesulfonamide
CID 43212835
(E)-N-[2-(ethylamino)ethyl]-2-phenylethenesulfonamide
CID 55100588
(E)-N-[3-(2-methoxyethoxy)propyl]-2-phenylethenesulfonamide
CID 47121888
2-[5-[3-(2,2-diphenylhydrazinyl)-3-oxopropyl]naphthalen-1-yl]oxyacetic acid
CID 15434956

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-2-[5-[2-(2-phenylethenylsulfonylamino)ethyl]naphthalen-1-yl]oxyacetamide?
The IUPAC name of N,N-dimethyl-2-[5-[2-(2-phenylethenylsulfonylamino)ethyl]naphthalen-1-yl]oxyacetamide (CID 54193107) is N,N-dimethyl-2-[5-[2-(2-phenylethenylsulfonylamino)ethyl]naphthalen-1-yl]oxyacetamide.
What is the SMILES notation for N,N-dimethyl-2-[5-[2-(2-phenylethenylsulfonylamino)ethyl]naphthalen-1-yl]oxyacetamide?
The canonical SMILES for N,N-dimethyl-2-[5-[2-(2-phenylethenylsulfonylamino)ethyl]naphthalen-1-yl]oxyacetamide is CN(C)C(=O)COc1cccc2c(CCNS(=O)(=O)C=Cc3ccccc3)cccc12.
What is the InChIKey of N,N-dimethyl-2-[5-[2-(2-phenylethenylsulfonylamino)ethyl]naphthalen-1-yl]oxyacetamide?
The InChIKey is PJWMZCOSVVTOEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H26N2O4S/c1-26(2)24(27)18-30-23-13-7-11-21-20(10-6-12-22(21)23)14-16-25-31(28,29)17-15-19-8-4-3-5-9-19/h3-13,15,17,25H,14,16,18H2,1-2H3.
What are the key properties of N,N-dimethyl-2-[5-[2-(2-phenylethenylsulfonylamino)ethyl]naphthalen-1-yl]oxyacetamide?
N,N-dimethyl-2-[5-[2-(2-phenylethenylsulfonylamino)ethyl]naphthalen-1-yl]oxyacetamide has a molecular weight of 438.55 g/mol, XLogP of 3.44, 9 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-2-[5-[2-(2-phenylethenylsulfonylamino)ethyl]naphthalen-1-yl]oxyacetamide is sourced from PubChem (CID 54193107), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).