N-(4-morpholin-4-ylsulfonylphenyl)benzamide

C17H18N2O4S — CID 2811587

IUPACN-(4-morpholin-4-ylsulfonylphenyl)benzamide
SMILESO=C(Nc1ccc(S(=O)(=O)N2CCOCC2)cc1)c1ccccc1
InChIInChI=1S/C17H18N2O4S/c20-17(14-4-2-1-3-5-14)18-15-6-8-16(9-7-15)24(21,22)19-10-12-23-13-11-19/h1-9H,10-13H2,(H,18,20)
InChIKeyLCYNKPQPDFSZHO-UHFFFAOYSA-N
MW346.41 g/mol
LogP1.96
Rot. Bonds4

About N-(4-morpholin-4-ylsulfonylphenyl)benzamide

N-(4-morpholin-4-ylsulfonylphenyl)benzamide (PubChem CID 2811587) has the molecular formula C17H18N2O4S and a molecular weight of 346.41 g/mol. Its IUPAC name is N-(4-morpholin-4-ylsulfonylphenyl)benzamide.

Molecular Properties

Compound NameN-(4-morpholin-4-ylsulfonylphenyl)benzamide
PubChem CID2811587
Molecular FormulaC17H18N2O4S
Molecular Weight346.41 g/mol
Exact Mass346.10
IUPAC NameN-(4-morpholin-4-ylsulfonylphenyl)benzamide
SMILESO=C(Nc1ccc(S(=O)(=O)N2CCOCC2)cc1)c1ccccc1
InChIInChI=1S/C17H18N2O4S/c20-17(14-4-2-1-3-5-14)18-15-6-8-16(9-7-15)24(21,22)19-10-12-23-13-11-19/h1-9H,10-13H2,(H,18,20)
InChIKeyLCYNKPQPDFSZHO-UHFFFAOYSA-N
XLogP1.96
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.41
LogP ≤ 51.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(4-morpholin-4-ylsulfonylphenyl)benzamide?
The IUPAC name of N-(4-morpholin-4-ylsulfonylphenyl)benzamide (CID 2811587) is N-(4-morpholin-4-ylsulfonylphenyl)benzamide.
What is the SMILES notation for N-(4-morpholin-4-ylsulfonylphenyl)benzamide?
The canonical SMILES for N-(4-morpholin-4-ylsulfonylphenyl)benzamide is O=C(Nc1ccc(S(=O)(=O)N2CCOCC2)cc1)c1ccccc1.
What is the InChIKey of N-(4-morpholin-4-ylsulfonylphenyl)benzamide?
The InChIKey is LCYNKPQPDFSZHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N2O4S/c20-17(14-4-2-1-3-5-14)18-15-6-8-16(9-7-15)24(21,22)19-10-12-23-13-11-19/h1-9H,10-13H2,(H,18,20).
What are the key properties of N-(4-morpholin-4-ylsulfonylphenyl)benzamide?
N-(4-morpholin-4-ylsulfonylphenyl)benzamide has a molecular weight of 346.41 g/mol, XLogP of 1.96, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-morpholin-4-ylsulfonylphenyl)benzamide is sourced from PubChem (CID 2811587), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).