2-phenoxy-N-[4-(phenylsulfamoyl)phenyl]propanamide

C21H20N2O4S — CID 4939919

IUPAC2-phenoxy-N-[4-(phenylsulfamoyl)phenyl]propanamide
SMILESCC(Oc1ccccc1)C(=O)Nc1ccc(S(=O)(=O)Nc2ccccc2)cc1
InChIInChI=1S/C21H20N2O4S/c1-16(27-19-10-6-3-7-11-19)21(24)22-17-12-14-20(15-13-17)28(25,26)23-18-8-4-2-5-9-18/h2-16,23H,1H3,(H,22,24)
InChIKeySNGRWARHQBZLEH-UHFFFAOYSA-N
MW396.47 g/mol
LogP3.89
Rot. Bonds7

About 2-phenoxy-N-[4-(phenylsulfamoyl)phenyl]propanamide

2-phenoxy-N-[4-(phenylsulfamoyl)phenyl]propanamide (PubChem CID 4939919) has the molecular formula C21H20N2O4S and a molecular weight of 396.47 g/mol. Its IUPAC name is 2-phenoxy-N-[4-(phenylsulfamoyl)phenyl]propanamide.

Molecular Properties

Compound Name2-phenoxy-N-[4-(phenylsulfamoyl)phenyl]propanamide
PubChem CID4939919
Molecular FormulaC21H20N2O4S
Molecular Weight396.47 g/mol
Exact Mass396.11
IUPAC Name2-phenoxy-N-[4-(phenylsulfamoyl)phenyl]propanamide
SMILESCC(Oc1ccccc1)C(=O)Nc1ccc(S(=O)(=O)Nc2ccccc2)cc1
InChIInChI=1S/C21H20N2O4S/c1-16(27-19-10-6-3-7-11-19)21(24)22-17-12-14-20(15-13-17)28(25,26)23-18-8-4-2-5-9-18/h2-16,23H,1H3,(H,22,24)
InChIKeySNGRWARHQBZLEH-UHFFFAOYSA-N
XLogP3.89
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500396.47
LogP ≤ 53.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

(2R)-2-(4-methoxyphenoxy)-N-[4-(phenylsulfamoyl)phenyl]propanamide
CID 41479035
(2R)-2-(4-methylphenoxy)-N-[4-(phenylsulfamoyl)phenyl]propanamide
CID 41269416
N-[4-[(4-methoxyphenyl)sulfamoyl]phenyl]-2-phenoxypropanamide
CID 4939891
2-(4-acetylphenoxy)-N-[4-(phenylsulfamoyl)phenyl]propanamide
CID 24638155
(2S)-2-(4-methoxyphenoxy)-N-[4-[(4-methoxyphenyl)sulfamoyl]phenyl]propanamide
CID 42063919
2-phenoxy-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]propanamide
CID 3148025
(2R)-N-methyl-2-[4-(phenylsulfamoyl)phenoxy]propanamide
CID 92513136
N-[4-(phenylsulfamoyl)phenyl]-2-(2-propan-2-ylphenoxy)propanamide
CID 43915337
N-[3-[(4-methoxyphenyl)sulfamoyl]phenyl]-2-phenoxypropanamide
CID 24639819
N-[4-(cyclohexylsulfamoyl)phenyl]-2-phenoxypropanamide
CID 2973953
(2S)-2-(4-methoxyphenoxy)-N-[4-(pyridin-3-ylsulfamoyl)phenyl]propanamide
CID 28632657
N-[4-[(4-methoxyphenyl)sulfamoyl]phenyl]-2-(4-propan-2-ylphenoxy)propanamide
CID 4953580

Frequently Asked Questions

What is the IUPAC name of 2-phenoxy-N-[4-(phenylsulfamoyl)phenyl]propanamide?
The IUPAC name of 2-phenoxy-N-[4-(phenylsulfamoyl)phenyl]propanamide (CID 4939919) is 2-phenoxy-N-[4-(phenylsulfamoyl)phenyl]propanamide.
What is the SMILES notation for 2-phenoxy-N-[4-(phenylsulfamoyl)phenyl]propanamide?
The canonical SMILES for 2-phenoxy-N-[4-(phenylsulfamoyl)phenyl]propanamide is CC(Oc1ccccc1)C(=O)Nc1ccc(S(=O)(=O)Nc2ccccc2)cc1.
What is the InChIKey of 2-phenoxy-N-[4-(phenylsulfamoyl)phenyl]propanamide?
The InChIKey is SNGRWARHQBZLEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H20N2O4S/c1-16(27-19-10-6-3-7-11-19)21(24)22-17-12-14-20(15-13-17)28(25,26)23-18-8-4-2-5-9-18/h2-16,23H,1H3,(H,22,24).
What are the key properties of 2-phenoxy-N-[4-(phenylsulfamoyl)phenyl]propanamide?
2-phenoxy-N-[4-(phenylsulfamoyl)phenyl]propanamide has a molecular weight of 396.47 g/mol, XLogP of 3.89, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenoxy-N-[4-(phenylsulfamoyl)phenyl]propanamide is sourced from PubChem (CID 4939919), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).