N-(3-morpholin-4-ylsulfonylphenyl)-2-naphthalen-2-yloxyacetamide

C22H22N2O5S — CID 17070441

IUPACN-(3-morpholin-4-ylsulfonylphenyl)-2-naphthalen-2-yloxyacetamide
SMILESO=C(COc1ccc2ccccc2c1)Nc1cccc(S(=O)(=O)N2CCOCC2)c1
InChIInChI=1S/C22H22N2O5S/c25-22(16-29-20-9-8-17-4-1-2-5-18(17)14-20)23-19-6-3-7-21(15-19)30(26,27)24-10-12-28-13-11-24/h1-9,14-15H,10-13,16H2,(H,23,25)
InChIKeyUJPJMXGDFLOEPB-UHFFFAOYSA-N
MW426.49 g/mol
LogP2.88
Rot. Bonds6

About N-(3-morpholin-4-ylsulfonylphenyl)-2-naphthalen-2-yloxyacetamide

N-(3-morpholin-4-ylsulfonylphenyl)-2-naphthalen-2-yloxyacetamide (PubChem CID 17070441) has the molecular formula C22H22N2O5S and a molecular weight of 426.49 g/mol. Its IUPAC name is N-(3-morpholin-4-ylsulfonylphenyl)-2-naphthalen-2-yloxyacetamide.

Molecular Properties

Compound NameN-(3-morpholin-4-ylsulfonylphenyl)-2-naphthalen-2-yloxyacetamide
PubChem CID17070441
Molecular FormulaC22H22N2O5S
Molecular Weight426.49 g/mol
Exact Mass426.12
IUPAC NameN-(3-morpholin-4-ylsulfonylphenyl)-2-naphthalen-2-yloxyacetamide
SMILESO=C(COc1ccc2ccccc2c1)Nc1cccc(S(=O)(=O)N2CCOCC2)c1
InChIInChI=1S/C22H22N2O5S/c25-22(16-29-20-9-8-17-4-1-2-5-18(17)14-20)23-19-6-3-7-21(15-19)30(26,27)24-10-12-28-13-11-24/h1-9,14-15H,10-13,16H2,(H,23,25)
InChIKeyUJPJMXGDFLOEPB-UHFFFAOYSA-N
XLogP2.88
TPSA84.94 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500426.49
LogP ≤ 52.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-(4-tert-butylphenoxy)-N-(3-morpholin-4-ylsulfonylphenyl)acetamide
CID 17070440
2-[4-(cyanomethyl)phenoxy]-N-(3-morpholin-4-ylsulfonylphenyl)acetamide
CID 55313139
2-(4-morpholin-4-ylsulfonylphenoxy)-N-phenylacetamide
CID 2230342
N-(3-ethylphenyl)-2-(4-morpholin-4-ylsulfonylphenoxy)acetamide
CID 7612849
[2-(3-morpholin-4-ylsulfonylanilino)-2-oxoethyl] 4-ethoxybenzoate
CID 55315274
[2-(3-morpholin-4-ylsulfonylanilino)-2-oxoethyl] 3-quinolin-2-ylpropanoate
CID 43026610
[2-(3-morpholin-4-ylsulfonylanilino)-2-oxoethyl] cyclopropanecarboxylate
CID 3569637
[2-(3-morpholin-4-ylsulfonylanilino)-2-oxoethyl] 2-methylbenzoate
CID 4853968
2-(3-methylphenoxy)-N-(3-pyrrolidin-1-ylsulfonylphenyl)acetamide
CID 9415053
N-[4-(4-methylpiperidin-1-yl)sulfonylphenyl]-2-naphthalen-2-yloxyacetamide
CID 1010620
N-[4-(4-benzhydrylpiperazin-1-yl)sulfonylphenyl]-2-naphthalen-2-yloxyacetamide
CID 4946367
[2-(3-morpholin-4-ylsulfonylanilino)-2-oxoethyl] 5-methylfuran-2-carboxylate
CID 4854297

Frequently Asked Questions

What is the IUPAC name of N-(3-morpholin-4-ylsulfonylphenyl)-2-naphthalen-2-yloxyacetamide?
The IUPAC name of N-(3-morpholin-4-ylsulfonylphenyl)-2-naphthalen-2-yloxyacetamide (CID 17070441) is N-(3-morpholin-4-ylsulfonylphenyl)-2-naphthalen-2-yloxyacetamide.
What is the SMILES notation for N-(3-morpholin-4-ylsulfonylphenyl)-2-naphthalen-2-yloxyacetamide?
The canonical SMILES for N-(3-morpholin-4-ylsulfonylphenyl)-2-naphthalen-2-yloxyacetamide is O=C(COc1ccc2ccccc2c1)Nc1cccc(S(=O)(=O)N2CCOCC2)c1.
What is the InChIKey of N-(3-morpholin-4-ylsulfonylphenyl)-2-naphthalen-2-yloxyacetamide?
The InChIKey is UJPJMXGDFLOEPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H22N2O5S/c25-22(16-29-20-9-8-17-4-1-2-5-18(17)14-20)23-19-6-3-7-21(15-19)30(26,27)24-10-12-28-13-11-24/h1-9,14-15H,10-13,16H2,(H,23,25).
What are the key properties of N-(3-morpholin-4-ylsulfonylphenyl)-2-naphthalen-2-yloxyacetamide?
N-(3-morpholin-4-ylsulfonylphenyl)-2-naphthalen-2-yloxyacetamide has a molecular weight of 426.49 g/mol, XLogP of 2.88, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-morpholin-4-ylsulfonylphenyl)-2-naphthalen-2-yloxyacetamide is sourced from PubChem (CID 17070441), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).