4-(benzenesulfonamido)-N-[(1R)-2-morpholin-4-yl-1-phenylethyl]benzamide

C25H27N3O4S — CID 31429984

IUPAC4-(benzenesulfonamido)-N-[(1R)-2-morpholin-4-yl-1-phenylethyl]benzamide
SMILESO=C(N[C@@H](CN1CCOCC1)c1ccccc1)c1ccc(NS(=O)(=O)c2ccccc2)cc1
InChIInChI=1S/C25H27N3O4S/c29-25(26-24(20-7-3-1-4-8-20)19-28-15-17-32-18-16-28)21-11-13-22(14-12-21)27-33(30,31)23-9-5-2-6-10-23/h1-14,24,27H,15-19H2,(H,26,29)/t24-/m0/s1
InChIKeyBBRCKMFDAMJPJZ-DEOSSOPVSA-N
MW465.58 g/mol
LogP3.29
Rot. Bonds8

About 4-(benzenesulfonamido)-N-[(1R)-2-morpholin-4-yl-1-phenylethyl]benzamide

4-(benzenesulfonamido)-N-[(1R)-2-morpholin-4-yl-1-phenylethyl]benzamide (PubChem CID 31429984) has the molecular formula C25H27N3O4S and a molecular weight of 465.58 g/mol. Its IUPAC name is 4-(benzenesulfonamido)-N-[(1R)-2-morpholin-4-yl-1-phenylethyl]benzamide.

Molecular Properties

Compound Name4-(benzenesulfonamido)-N-[(1R)-2-morpholin-4-yl-1-phenylethyl]benzamide
PubChem CID31429984
Molecular FormulaC25H27N3O4S
Molecular Weight465.58 g/mol
Exact Mass465.17
IUPAC Name4-(benzenesulfonamido)-N-[(1R)-2-morpholin-4-yl-1-phenylethyl]benzamide
SMILESO=C(N[C@@H](CN1CCOCC1)c1ccccc1)c1ccc(NS(=O)(=O)c2ccccc2)cc1
InChIInChI=1S/C25H27N3O4S/c29-25(26-24(20-7-3-1-4-8-20)19-28-15-17-32-18-16-28)21-11-13-22(14-12-21)27-33(30,31)23-9-5-2-6-10-23/h1-14,24,27H,15-19H2,(H,26,29)/t24-/m0/s1
InChIKeyBBRCKMFDAMJPJZ-DEOSSOPVSA-N
XLogP3.29
TPSA87.74 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500465.58
LogP ≤ 53.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 4-(benzenesulfonamido)-N-[(1R)-2-morpholin-4-yl-1-phenylethyl]benzamide with MolForge

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Related Compounds

3-[(4-methylphenyl)sulfamoyl]-N-[(1S)-2-morpholin-4-yl-1-phenylethyl]benzamide
CID 30102988
4-acetamido-N-(2-morpholin-4-yl-1-phenylethyl)benzamide
CID 18166742
4-(azepan-1-ylsulfonyl)-N-[(1S)-2-morpholin-4-yl-1-phenylethyl]benzamide
CID 31397272
4-[methyl(phenyl)sulfamoyl]-N-[(1R)-2-morpholin-4-yl-1-phenylethyl]benzamide
CID 31444660
4-methylsulfanyl-N-[(1R)-2-morpholin-4-yl-1-phenylethyl]benzamide
CID 9149987
5-bromo-N-[4-[(2-morpholin-4-yl-1-phenylethyl)carbamoyl]phenyl]furan-2-carboxamide
CID 112834585
3-(benzylsulfamoyl)-N-[(1S)-2-morpholin-4-yl-1-phenylethyl]benzamide
CID 31444209
4-(acetamidomethyl)-N-(2-morpholin-4-yl-1-phenylethyl)benzamide
CID 18166767
3,5-dimethyl-N-[(1S)-2-morpholin-4-yl-1-phenylethyl]benzamide
CID 25485403
[(1S)-2-morpholin-4-yl-1-phenylethyl]carbamic acid
CID 68931667
N-[4-[[(1S)-2-morpholin-4-yl-1-phenylethyl]sulfamoyl]phenyl]acetamide
CID 8844906
2-hydroxy-N-(2-morpholin-4-yl-1-phenylethyl)benzamide
CID 86918289

Frequently Asked Questions

What is the IUPAC name of 4-(benzenesulfonamido)-N-[(1R)-2-morpholin-4-yl-1-phenylethyl]benzamide?
The IUPAC name of 4-(benzenesulfonamido)-N-[(1R)-2-morpholin-4-yl-1-phenylethyl]benzamide (CID 31429984) is 4-(benzenesulfonamido)-N-[(1R)-2-morpholin-4-yl-1-phenylethyl]benzamide.
What is the SMILES notation for 4-(benzenesulfonamido)-N-[(1R)-2-morpholin-4-yl-1-phenylethyl]benzamide?
The canonical SMILES for 4-(benzenesulfonamido)-N-[(1R)-2-morpholin-4-yl-1-phenylethyl]benzamide is O=C(N[C@@H](CN1CCOCC1)c1ccccc1)c1ccc(NS(=O)(=O)c2ccccc2)cc1.
What is the InChIKey of 4-(benzenesulfonamido)-N-[(1R)-2-morpholin-4-yl-1-phenylethyl]benzamide?
The InChIKey is BBRCKMFDAMJPJZ-DEOSSOPVSA-N. The full InChI is InChI=1S/C25H27N3O4S/c29-25(26-24(20-7-3-1-4-8-20)19-28-15-17-32-18-16-28)21-11-13-22(14-12-21)27-33(30,31)23-9-5-2-6-10-23/h1-14,24,27H,15-19H2,(H,26,29)/t24-/m0/s1.
What are the key properties of 4-(benzenesulfonamido)-N-[(1R)-2-morpholin-4-yl-1-phenylethyl]benzamide?
4-(benzenesulfonamido)-N-[(1R)-2-morpholin-4-yl-1-phenylethyl]benzamide has a molecular weight of 465.58 g/mol, XLogP of 3.29, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(benzenesulfonamido)-N-[(1R)-2-morpholin-4-yl-1-phenylethyl]benzamide is sourced from PubChem (CID 31429984), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).