N-[4-[phenyl(1-pyridin-2-ylethyl)sulfamoyl]phenyl]acetamide

C21H21N3O3S — CID 3712981

IUPACN-[4-[phenyl(1-pyridin-2-ylethyl)sulfamoyl]phenyl]acetamide
SMILESCC(=O)Nc1ccc(S(=O)(=O)N(c2ccccc2)C(C)c2ccccn2)cc1
InChIInChI=1S/C21H21N3O3S/c1-16(21-10-6-7-15-22-21)24(19-8-4-3-5-9-19)28(26,27)20-13-11-18(12-14-20)23-17(2)25/h3-16H,1-2H3,(H,23,25)
InChIKeyGQLIRXAGDGRPKD-UHFFFAOYSA-N
MW395.48 g/mol
LogP4.00
Rot. Bonds6

About N-[4-[phenyl(1-pyridin-2-ylethyl)sulfamoyl]phenyl]acetamide

N-[4-[phenyl(1-pyridin-2-ylethyl)sulfamoyl]phenyl]acetamide (PubChem CID 3712981) has the molecular formula C21H21N3O3S and a molecular weight of 395.48 g/mol. Its IUPAC name is N-[4-[phenyl(1-pyridin-2-ylethyl)sulfamoyl]phenyl]acetamide.

Molecular Properties

Compound NameN-[4-[phenyl(1-pyridin-2-ylethyl)sulfamoyl]phenyl]acetamide
PubChem CID3712981
Molecular FormulaC21H21N3O3S
Molecular Weight395.48 g/mol
Exact Mass395.13
IUPAC NameN-[4-[phenyl(1-pyridin-2-ylethyl)sulfamoyl]phenyl]acetamide
SMILESCC(=O)Nc1ccc(S(=O)(=O)N(c2ccccc2)C(C)c2ccccn2)cc1
InChIInChI=1S/C21H21N3O3S/c1-16(21-10-6-7-15-22-21)24(19-8-4-3-5-9-19)28(26,27)20-13-11-18(12-14-20)23-17(2)25/h3-16H,1-2H3,(H,23,25)
InChIKeyGQLIRXAGDGRPKD-UHFFFAOYSA-N
XLogP4.00
TPSA79.37 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500395.48
LogP ≤ 54.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-fluoro-N-phenyl-N-(1-pyridin-2-ylethyl)benzenesulfonamide
CID 3741145
2-(N-(4-acetamidophenyl)sulfonylanilino)propanoic acid
CID 50889074
N-[4-(diphenylsulfamoyl)phenyl]acetamide
CID 4296300
N,1-diphenyl-N-(1-pyridin-2-ylethyl)methanesulfonamide
CID 4209849
2-(N-(4-acetamidophenyl)sulfonyl-4-methylanilino)propanoyl chloride
CID 50889175
2-(N-(4-acetamidophenyl)sulfonyl-4-propan-2-ylanilino)propanoyl chloride
CID 50889358
2-(N-(4-acetamidophenyl)sulfonyl-2-chloroanilino)propanoyl chloride
CID 50889097
N-[4-[(4-methoxyphenyl)-[(1R)-1-(3-methylphenyl)ethyl]sulfamoyl]phenyl]acetamide
CID 93207362
2-(N-(4-acetamidophenyl)sulfonylanilino)acetyl chloride
CID 50889182
N-[4-[2-phenylethyl(pyridin-2-ylmethyl)sulfamoyl]phenyl]acetamide
CID 121084567
2-[(4-acetamidophenyl)sulfonyl-methylamino]pyridine-3-carboxylic acid
CID 4738961
2-[(4-acetamidophenyl)sulfonyl-methylamino]-N-methyl-N-(1-phenylethyl)acetamide
CID 43022013

Frequently Asked Questions

What is the IUPAC name of N-[4-[phenyl(1-pyridin-2-ylethyl)sulfamoyl]phenyl]acetamide?
The IUPAC name of N-[4-[phenyl(1-pyridin-2-ylethyl)sulfamoyl]phenyl]acetamide (CID 3712981) is N-[4-[phenyl(1-pyridin-2-ylethyl)sulfamoyl]phenyl]acetamide.
What is the SMILES notation for N-[4-[phenyl(1-pyridin-2-ylethyl)sulfamoyl]phenyl]acetamide?
The canonical SMILES for N-[4-[phenyl(1-pyridin-2-ylethyl)sulfamoyl]phenyl]acetamide is CC(=O)Nc1ccc(S(=O)(=O)N(c2ccccc2)C(C)c2ccccn2)cc1.
What is the InChIKey of N-[4-[phenyl(1-pyridin-2-ylethyl)sulfamoyl]phenyl]acetamide?
The InChIKey is GQLIRXAGDGRPKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H21N3O3S/c1-16(21-10-6-7-15-22-21)24(19-8-4-3-5-9-19)28(26,27)20-13-11-18(12-14-20)23-17(2)25/h3-16H,1-2H3,(H,23,25).
What are the key properties of N-[4-[phenyl(1-pyridin-2-ylethyl)sulfamoyl]phenyl]acetamide?
N-[4-[phenyl(1-pyridin-2-ylethyl)sulfamoyl]phenyl]acetamide has a molecular weight of 395.48 g/mol, XLogP of 4.00, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[phenyl(1-pyridin-2-ylethyl)sulfamoyl]phenyl]acetamide is sourced from PubChem (CID 3712981), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).