N-(3-morpholin-4-ylsulfonylphenyl)-3-phenylpropanamide

C19H22N2O4S — CID 4043443

IUPACN-(3-morpholin-4-ylsulfonylphenyl)-3-phenylpropanamide
SMILESO=C(CCc1ccccc1)Nc1cccc(S(=O)(=O)N2CCOCC2)c1
InChIInChI=1S/C19H22N2O4S/c22-19(10-9-16-5-2-1-3-6-16)20-17-7-4-8-18(15-17)26(23,24)21-11-13-25-14-12-21/h1-8,15H,9-14H2,(H,20,22)
InChIKeyVHIAAEQWYVIFIT-UHFFFAOYSA-N
MW374.46 g/mol
LogP2.28
Rot. Bonds6

About N-(3-morpholin-4-ylsulfonylphenyl)-3-phenylpropanamide

N-(3-morpholin-4-ylsulfonylphenyl)-3-phenylpropanamide (PubChem CID 4043443) has the molecular formula C19H22N2O4S and a molecular weight of 374.46 g/mol. Its IUPAC name is N-(3-morpholin-4-ylsulfonylphenyl)-3-phenylpropanamide.

Molecular Properties

Compound NameN-(3-morpholin-4-ylsulfonylphenyl)-3-phenylpropanamide
PubChem CID4043443
Molecular FormulaC19H22N2O4S
Molecular Weight374.46 g/mol
Exact Mass374.13
IUPAC NameN-(3-morpholin-4-ylsulfonylphenyl)-3-phenylpropanamide
SMILESO=C(CCc1ccccc1)Nc1cccc(S(=O)(=O)N2CCOCC2)c1
InChIInChI=1S/C19H22N2O4S/c22-19(10-9-16-5-2-1-3-6-16)20-17-7-4-8-18(15-17)26(23,24)21-11-13-25-14-12-21/h1-8,15H,9-14H2,(H,20,22)
InChIKeyVHIAAEQWYVIFIT-UHFFFAOYSA-N
XLogP2.28
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.46
LogP ≤ 52.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(3-(Morpholinosulfonyl)phenyl)-3-(4-(trifluoromethyl)phenyl)urea
CID 24894570
N-[4-(4-morpholinylsulfonyl)phenyl]benzamide
CID 2811587
N-{5-[(dimethylamino)sulfonyl]-2-methylphenyl}-3-phenylpropanamide
CID 2812928
N-Phenyl-3-(1-piperidinylsulfonyl)benzamide
CID 558837
2-methyl-N-[4-(4-morpholinylsulfonyl)phenyl]benzamide
CID 1010558
N-(4-piperidin-1-ylsulfonylphenyl)cyclohexanecarboxamide
CID 1013273
(E)-N-(5-fluoro-2-methylphenyl)-3-(4-morpholin-4-ylsulfonylphenyl)prop-2-enamide
CID 2485069
(E)-N-(3-acetamidophenyl)-3-(4-morpholin-4-ylsulfonylphenyl)prop-2-enamide
CID 2489006
N-{5-[(dimethylamino)sulfonyl]-2-methylphenyl}cyclohexanecarboxamide
CID 2812913
2-(2-fluorophenyl)-N-(3-morpholin-4-ylsulfonylphenyl)acetamide
CID 3519434
4-cyclohexyl-N-(3-sulfamoylphenyl)butanamide
CID 3919954
2-oxo-N-(3-piperidin-1-ylsulfonylphenyl)-1H-quinoline-4-carboxamide
CID 3929877

Frequently Asked Questions

What is the IUPAC name of N-(3-morpholin-4-ylsulfonylphenyl)-3-phenylpropanamide?
The IUPAC name of N-(3-morpholin-4-ylsulfonylphenyl)-3-phenylpropanamide (CID 4043443) is N-(3-morpholin-4-ylsulfonylphenyl)-3-phenylpropanamide.
What is the SMILES notation for N-(3-morpholin-4-ylsulfonylphenyl)-3-phenylpropanamide?
The canonical SMILES for N-(3-morpholin-4-ylsulfonylphenyl)-3-phenylpropanamide is O=C(CCc1ccccc1)Nc1cccc(S(=O)(=O)N2CCOCC2)c1.
What is the InChIKey of N-(3-morpholin-4-ylsulfonylphenyl)-3-phenylpropanamide?
The InChIKey is VHIAAEQWYVIFIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2O4S/c22-19(10-9-16-5-2-1-3-6-16)20-17-7-4-8-18(15-17)26(23,24)21-11-13-25-14-12-21/h1-8,15H,9-14H2,(H,20,22).
What are the key properties of N-(3-morpholin-4-ylsulfonylphenyl)-3-phenylpropanamide?
N-(3-morpholin-4-ylsulfonylphenyl)-3-phenylpropanamide has a molecular weight of 374.46 g/mol, XLogP of 2.28, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-morpholin-4-ylsulfonylphenyl)-3-phenylpropanamide is sourced from PubChem (CID 4043443), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).