N-(4-ethoxyphenyl)-2-[ethyl(naphthalen-2-ylsulfonyl)amino]acetamide

C22H24N2O4S — CID 1243481

IUPACN-(4-ethoxyphenyl)-2-[ethyl(naphthalen-2-ylsulfonyl)amino]acetamide
SMILESCCOc1ccc(NC(=O)CN(CC)S(=O)(=O)c2ccc3ccccc3c2)cc1
InChIInChI=1S/C22H24N2O4S/c1-3-24(16-22(25)23-19-10-12-20(13-11-19)28-4-2)29(26,27)21-14-9-17-7-5-6-8-18(17)15-21/h5-15H,3-4,16H2,1-2H3,(H,23,25)
InChIKeyKLWAFMTUKAYNAX-UHFFFAOYSA-N
MW412.51 g/mol
LogP3.89
Rot. Bonds8

About N-(4-ethoxyphenyl)-2-[ethyl(naphthalen-2-ylsulfonyl)amino]acetamide

N-(4-ethoxyphenyl)-2-[ethyl(naphthalen-2-ylsulfonyl)amino]acetamide (PubChem CID 1243481) has the molecular formula C22H24N2O4S and a molecular weight of 412.51 g/mol. Its IUPAC name is N-(4-ethoxyphenyl)-2-[ethyl(naphthalen-2-ylsulfonyl)amino]acetamide.

Molecular Properties

Compound NameN-(4-ethoxyphenyl)-2-[ethyl(naphthalen-2-ylsulfonyl)amino]acetamide
PubChem CID1243481
Molecular FormulaC22H24N2O4S
Molecular Weight412.51 g/mol
Exact Mass412.15
IUPAC NameN-(4-ethoxyphenyl)-2-[ethyl(naphthalen-2-ylsulfonyl)amino]acetamide
SMILESCCOc1ccc(NC(=O)CN(CC)S(=O)(=O)c2ccc3ccccc3c2)cc1
InChIInChI=1S/C22H24N2O4S/c1-3-24(16-22(25)23-19-10-12-20(13-11-19)28-4-2)29(26,27)21-14-9-17-7-5-6-8-18(17)15-21/h5-15H,3-4,16H2,1-2H3,(H,23,25)
InChIKeyKLWAFMTUKAYNAX-UHFFFAOYSA-N
XLogP3.89
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500412.51
LogP ≤ 53.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

ethyl 4-[[2-[ethyl(naphthalen-2-ylsulfonyl)amino]acetyl]amino]benzoate
CID 2217901
N-(4-acetamidophenyl)-2-[(4-ethoxyphenyl)sulfonyl-ethylamino]acetamide
CID 7937656
2-[(4-ethoxyphenyl)sulfonyl-ethylamino]-N-(4-propan-2-ylphenyl)acetamide
CID 45373181
2-[(4-ethoxyphenyl)sulfonyl-ethylamino]-N-(4-ethylphenyl)acetamide
CID 45373180
N-(3-bromophenyl)-2-[ethyl(naphthalen-2-ylsulfonyl)amino]acetamide
CID 2234331
2-[ethyl(naphthalen-2-ylsulfonyl)amino]-N-(2-methylphenyl)acetamide
CID 3485774
2-(N-(4-ethoxyphenyl)sulfonyl-4-fluoroanilino)-N-naphthalen-2-ylacetamide
CID 126387449
2-[benzyl-(3,4-dichlorophenyl)sulfonylamino]-N-(4-ethoxyphenyl)acetamide
CID 2695357
N-[4-chloro-3-(trifluoromethyl)phenyl]-2-[ethyl(naphthalen-2-ylsulfonyl)amino]acetamide
CID 45375647
2-[4-(diethylsulfamoyl)anilino]-N-naphthalen-2-ylacetamide
CID 9084099
2-[(3-chloro-4-ethoxyphenyl)sulfonyl-ethylamino]-N-(4-chlorophenyl)acetamide
CID 45373905
2-[ethyl(naphthalen-2-ylsulfonyl)amino]-N-[2-(trifluoromethyl)phenyl]acetamide
CID 2980569

Frequently Asked Questions

What is the IUPAC name of N-(4-ethoxyphenyl)-2-[ethyl(naphthalen-2-ylsulfonyl)amino]acetamide?
The IUPAC name of N-(4-ethoxyphenyl)-2-[ethyl(naphthalen-2-ylsulfonyl)amino]acetamide (CID 1243481) is N-(4-ethoxyphenyl)-2-[ethyl(naphthalen-2-ylsulfonyl)amino]acetamide.
What is the SMILES notation for N-(4-ethoxyphenyl)-2-[ethyl(naphthalen-2-ylsulfonyl)amino]acetamide?
The canonical SMILES for N-(4-ethoxyphenyl)-2-[ethyl(naphthalen-2-ylsulfonyl)amino]acetamide is CCOc1ccc(NC(=O)CN(CC)S(=O)(=O)c2ccc3ccccc3c2)cc1.
What is the InChIKey of N-(4-ethoxyphenyl)-2-[ethyl(naphthalen-2-ylsulfonyl)amino]acetamide?
The InChIKey is KLWAFMTUKAYNAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H24N2O4S/c1-3-24(16-22(25)23-19-10-12-20(13-11-19)28-4-2)29(26,27)21-14-9-17-7-5-6-8-18(17)15-21/h5-15H,3-4,16H2,1-2H3,(H,23,25).
What are the key properties of N-(4-ethoxyphenyl)-2-[ethyl(naphthalen-2-ylsulfonyl)amino]acetamide?
N-(4-ethoxyphenyl)-2-[ethyl(naphthalen-2-ylsulfonyl)amino]acetamide has a molecular weight of 412.51 g/mol, XLogP of 3.89, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-ethoxyphenyl)-2-[ethyl(naphthalen-2-ylsulfonyl)amino]acetamide is sourced from PubChem (CID 1243481), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).