4-methyl-3-morpholin-4-ylsulfonyl-N-(2-phenylethyl)benzamide

C20H24N2O4S — CID 6462071

IUPAC4-methyl-3-morpholin-4-ylsulfonyl-N-(2-phenylethyl)benzamide
SMILESCc1ccc(C(=O)NCCc2ccccc2)cc1S(=O)(=O)N1CCOCC1
InChIInChI=1S/C20H24N2O4S/c1-16-7-8-18(20(23)21-10-9-17-5-3-2-4-6-17)15-19(16)27(24,25)22-11-13-26-14-12-22/h2-8,15H,9-14H2,1H3,(H,21,23)
InChIKeyWDJFZGLOJOUMDF-UHFFFAOYSA-N
MW388.49 g/mol
LogP1.99
Rot. Bonds6

About 4-methyl-3-morpholin-4-ylsulfonyl-N-(2-phenylethyl)benzamide

4-methyl-3-morpholin-4-ylsulfonyl-N-(2-phenylethyl)benzamide (PubChem CID 6462071) has the molecular formula C20H24N2O4S and a molecular weight of 388.49 g/mol. Its IUPAC name is 4-methyl-3-morpholin-4-ylsulfonyl-N-(2-phenylethyl)benzamide.

Molecular Properties

Compound Name4-methyl-3-morpholin-4-ylsulfonyl-N-(2-phenylethyl)benzamide
PubChem CID6462071
Molecular FormulaC20H24N2O4S
Molecular Weight388.49 g/mol
Exact Mass388.15
IUPAC Name4-methyl-3-morpholin-4-ylsulfonyl-N-(2-phenylethyl)benzamide
SMILESCc1ccc(C(=O)NCCc2ccccc2)cc1S(=O)(=O)N1CCOCC1
InChIInChI=1S/C20H24N2O4S/c1-16-7-8-18(20(23)21-10-9-17-5-3-2-4-6-17)15-19(16)27(24,25)22-11-13-26-14-12-22/h2-8,15H,9-14H2,1H3,(H,21,23)
InChIKeyWDJFZGLOJOUMDF-UHFFFAOYSA-N
XLogP1.99
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.49
LogP ≤ 51.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

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CID 2144
N-cyclohexyl-3-piperidin-1-ylsulfonylbenzamide
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Phenylalanylaminodi(ethyloxy)ethyl benzenesulfonamideaminocarbonylbenzenesulfonamide
CID 444849
N-benzyl-4-bromo-3-(morpholinosulfonyl)benzamide
CID 1076739
N-[[4-(benzenesulfonamidomethyl)phenyl]methyl]benzamide
CID 130431459
N-[[4-(benzenesulfonamidomethyl)phenyl]methyl]-2-methyl-benzamide
CID 130431474
N-benzyl-3-piperidin-1-ylsulfonylbenzamide
CID 1076673
(4-Methylpiperidin-1-yl)(4-(morpholinosulfonyl)phenyl)methanone
CID 1158041
3-(3,4-Dihydroisoquinolin-2(1h)-Ylsulfonyl)-N-Methylbenzamide
CID 1217101
4-Sulfamoyl-N-(3-morpholinopropyl)benzamide (I-1)
CID 25060316
N-(2-hydroxyethyl)-4-(4-sulfamoylphenyl)benzamide
CID 122194774
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CID 155532736

Frequently Asked Questions

What is the IUPAC name of 4-methyl-3-morpholin-4-ylsulfonyl-N-(2-phenylethyl)benzamide?
The IUPAC name of 4-methyl-3-morpholin-4-ylsulfonyl-N-(2-phenylethyl)benzamide (CID 6462071) is 4-methyl-3-morpholin-4-ylsulfonyl-N-(2-phenylethyl)benzamide.
What is the SMILES notation for 4-methyl-3-morpholin-4-ylsulfonyl-N-(2-phenylethyl)benzamide?
The canonical SMILES for 4-methyl-3-morpholin-4-ylsulfonyl-N-(2-phenylethyl)benzamide is Cc1ccc(C(=O)NCCc2ccccc2)cc1S(=O)(=O)N1CCOCC1.
What is the InChIKey of 4-methyl-3-morpholin-4-ylsulfonyl-N-(2-phenylethyl)benzamide?
The InChIKey is WDJFZGLOJOUMDF-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O4S/c1-16-7-8-18(20(23)21-10-9-17-5-3-2-4-6-17)15-19(16)27(24,25)22-11-13-26-14-12-22/h2-8,15H,9-14H2,1H3,(H,21,23).
What are the key properties of 4-methyl-3-morpholin-4-ylsulfonyl-N-(2-phenylethyl)benzamide?
4-methyl-3-morpholin-4-ylsulfonyl-N-(2-phenylethyl)benzamide has a molecular weight of 388.49 g/mol, XLogP of 1.99, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-3-morpholin-4-ylsulfonyl-N-(2-phenylethyl)benzamide is sourced from PubChem (CID 6462071), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).