N-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)-2,2-diphenylacetamide

C25H26N2O5S — CID 3594308

IUPACN-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)-2,2-diphenylacetamide
SMILESCOc1ccc(S(=O)(=O)N2CCOCC2)cc1NC(=O)C(c1ccccc1)c1ccccc1
InChIInChI=1S/C25H26N2O5S/c1-31-23-13-12-21(33(29,30)27-14-16-32-17-15-27)18-22(23)26-25(28)24(19-8-4-2-5-9-19)20-10-6-3-7-11-20/h2-13,18,24H,14-17H2,1H3,(H,26,28)
InChIKeyMGWKNUJICZEBFO-UHFFFAOYSA-N
MW466.56 g/mol
LogP3.49
Rot. Bonds7

About N-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)-2,2-diphenylacetamide

N-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)-2,2-diphenylacetamide (PubChem CID 3594308) has the molecular formula C25H26N2O5S and a molecular weight of 466.56 g/mol. Its IUPAC name is N-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)-2,2-diphenylacetamide.

Molecular Properties

Compound NameN-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)-2,2-diphenylacetamide
PubChem CID3594308
Molecular FormulaC25H26N2O5S
Molecular Weight466.56 g/mol
Exact Mass466.16
IUPAC NameN-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)-2,2-diphenylacetamide
SMILESCOc1ccc(S(=O)(=O)N2CCOCC2)cc1NC(=O)C(c1ccccc1)c1ccccc1
InChIInChI=1S/C25H26N2O5S/c1-31-23-13-12-21(33(29,30)27-14-16-32-17-15-27)18-22(23)26-25(28)24(19-8-4-2-5-9-19)20-10-6-3-7-11-20/h2-13,18,24H,14-17H2,1H3,(H,26,28)
InChIKeyMGWKNUJICZEBFO-UHFFFAOYSA-N
XLogP3.49
TPSA84.94 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms33
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500466.56
LogP ≤ 53.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)-2,2-diphenylacetamide?
The IUPAC name of N-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)-2,2-diphenylacetamide (CID 3594308) is N-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)-2,2-diphenylacetamide.
What is the SMILES notation for N-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)-2,2-diphenylacetamide?
The canonical SMILES for N-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)-2,2-diphenylacetamide is COc1ccc(S(=O)(=O)N2CCOCC2)cc1NC(=O)C(c1ccccc1)c1ccccc1.
What is the InChIKey of N-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)-2,2-diphenylacetamide?
The InChIKey is MGWKNUJICZEBFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H26N2O5S/c1-31-23-13-12-21(33(29,30)27-14-16-32-17-15-27)18-22(23)26-25(28)24(19-8-4-2-5-9-19)20-10-6-3-7-11-20/h2-13,18,24H,14-17H2,1H3,(H,26,28).
What are the key properties of N-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)-2,2-diphenylacetamide?
N-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)-2,2-diphenylacetamide has a molecular weight of 466.56 g/mol, XLogP of 3.49, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)-2,2-diphenylacetamide is sourced from PubChem (CID 3594308), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).