N-[5-(diethylsulfamoyl)-2-morpholin-4-ylphenyl]-2-phenylacetamide

C22H29N3O4S — CID 15945406

IUPACN-[5-(diethylsulfamoyl)-2-morpholin-4-ylphenyl]-2-phenylacetamide
SMILESCCN(CC)S(=O)(=O)c1ccc(N2CCOCC2)c(NC(=O)Cc2ccccc2)c1
InChIInChI=1S/C22H29N3O4S/c1-3-25(4-2)30(27,28)19-10-11-21(24-12-14-29-15-13-24)20(17-19)23-22(26)16-18-8-6-5-7-9-18/h5-11,17H,3-4,12-16H2,1-2H3,(H,23,26)
InChIKeyMXHBBUUVEHHHMT-UHFFFAOYSA-N
MW431.56 g/mol
LogP2.73
Rot. Bonds8

About N-[5-(diethylsulfamoyl)-2-morpholin-4-ylphenyl]-2-phenylacetamide

N-[5-(diethylsulfamoyl)-2-morpholin-4-ylphenyl]-2-phenylacetamide (PubChem CID 15945406) has the molecular formula C22H29N3O4S and a molecular weight of 431.56 g/mol. Its IUPAC name is N-[5-(diethylsulfamoyl)-2-morpholin-4-ylphenyl]-2-phenylacetamide.

Molecular Properties

Compound NameN-[5-(diethylsulfamoyl)-2-morpholin-4-ylphenyl]-2-phenylacetamide
PubChem CID15945406
Molecular FormulaC22H29N3O4S
Molecular Weight431.56 g/mol
Exact Mass431.19
IUPAC NameN-[5-(diethylsulfamoyl)-2-morpholin-4-ylphenyl]-2-phenylacetamide
SMILESCCN(CC)S(=O)(=O)c1ccc(N2CCOCC2)c(NC(=O)Cc2ccccc2)c1
InChIInChI=1S/C22H29N3O4S/c1-3-25(4-2)30(27,28)19-10-11-21(24-12-14-29-15-13-24)20(17-19)23-22(26)16-18-8-6-5-7-9-18/h5-11,17H,3-4,12-16H2,1-2H3,(H,23,26)
InChIKeyMXHBBUUVEHHHMT-UHFFFAOYSA-N
XLogP2.73
TPSA78.95 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500431.56
LogP ≤ 52.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[5-(diethylsulfamoyl)-2-morpholin-4-ylphenyl]-2-phenylacetamide?
The IUPAC name of N-[5-(diethylsulfamoyl)-2-morpholin-4-ylphenyl]-2-phenylacetamide (CID 15945406) is N-[5-(diethylsulfamoyl)-2-morpholin-4-ylphenyl]-2-phenylacetamide.
What is the SMILES notation for N-[5-(diethylsulfamoyl)-2-morpholin-4-ylphenyl]-2-phenylacetamide?
The canonical SMILES for N-[5-(diethylsulfamoyl)-2-morpholin-4-ylphenyl]-2-phenylacetamide is CCN(CC)S(=O)(=O)c1ccc(N2CCOCC2)c(NC(=O)Cc2ccccc2)c1.
What is the InChIKey of N-[5-(diethylsulfamoyl)-2-morpholin-4-ylphenyl]-2-phenylacetamide?
The InChIKey is MXHBBUUVEHHHMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H29N3O4S/c1-3-25(4-2)30(27,28)19-10-11-21(24-12-14-29-15-13-24)20(17-19)23-22(26)16-18-8-6-5-7-9-18/h5-11,17H,3-4,12-16H2,1-2H3,(H,23,26).
What are the key properties of N-[5-(diethylsulfamoyl)-2-morpholin-4-ylphenyl]-2-phenylacetamide?
N-[5-(diethylsulfamoyl)-2-morpholin-4-ylphenyl]-2-phenylacetamide has a molecular weight of 431.56 g/mol, XLogP of 2.73, 8 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-(diethylsulfamoyl)-2-morpholin-4-ylphenyl]-2-phenylacetamide is sourced from PubChem (CID 15945406), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).