2-anilino-N-[1-[4-(diethylsulfamoyl)phenyl]ethyl]acetamide

C20H27N3O3S — CID 119686819

IUPAC2-anilino-N-[1-[4-(diethylsulfamoyl)phenyl]ethyl]acetamide
SMILESCCN(CC)S(=O)(=O)c1ccc(C(C)NC(=O)CNc2ccccc2)cc1
InChIInChI=1S/C20H27N3O3S/c1-4-23(5-2)27(25,26)19-13-11-17(12-14-19)16(3)22-20(24)15-21-18-9-7-6-8-10-18/h6-14,16,21H,4-5,15H2,1-3H3,(H,22,24)
InChIKeyXMXVELXNHJYWDY-UHFFFAOYSA-N
MW389.52 g/mol
LogP3.01
Rot. Bonds9

About 2-anilino-N-[1-[4-(diethylsulfamoyl)phenyl]ethyl]acetamide

2-anilino-N-[1-[4-(diethylsulfamoyl)phenyl]ethyl]acetamide (PubChem CID 119686819) has the molecular formula C20H27N3O3S and a molecular weight of 389.52 g/mol. Its IUPAC name is 2-anilino-N-[1-[4-(diethylsulfamoyl)phenyl]ethyl]acetamide.

Molecular Properties

Compound Name2-anilino-N-[1-[4-(diethylsulfamoyl)phenyl]ethyl]acetamide
PubChem CID119686819
Molecular FormulaC20H27N3O3S
Molecular Weight389.52 g/mol
Exact Mass389.18
IUPAC Name2-anilino-N-[1-[4-(diethylsulfamoyl)phenyl]ethyl]acetamide
SMILESCCN(CC)S(=O)(=O)c1ccc(C(C)NC(=O)CNc2ccccc2)cc1
InChIInChI=1S/C20H27N3O3S/c1-4-23(5-2)27(25,26)19-13-11-17(12-14-19)16(3)22-20(24)15-21-18-9-7-6-8-10-18/h6-14,16,21H,4-5,15H2,1-3H3,(H,22,24)
InChIKeyXMXVELXNHJYWDY-UHFFFAOYSA-N
XLogP3.01
TPSA78.51 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500389.52
LogP ≤ 53.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-anilino-N-(1-phenylethyl)acetamide
CID 54810260
3-amino-N-[1-[4-(diethylsulfamoyl)phenyl]ethyl]butanamide;hydrochloride
CID 119686834
[2-oxo-2-[[(1R)-1-phenylethyl]amino]ethyl] 4-(diethylsulfamoyl)benzoate
CID 2557690
N-[1-[4-(diethylsulfamoyl)phenyl]ethyl]-2-phenoxypropanamide
CID 55339007
(2R)-2-amino-N-[1-[4-(diethylsulfamoyl)phenyl]ethyl]propanamide
CID 119269826
N-[(1S)-1-(4-bromophenyl)ethyl]-2-[(4-bromophenyl)sulfonyl-ethylamino]acetamide
CID 28547717
N-[1-(4-chlorophenyl)ethyl]-2-[(4-chlorophenyl)sulfonyl-ethylamino]acetamide
CID 43872409
N-[(1R)-1-(4-chlorophenyl)ethyl]-2-[(4-chlorophenyl)sulfonyl-ethylamino]acetamide
CID 28547139
(2R)-2-amino-N-[1-[4-(diethylsulfamoyl)phenyl]ethyl]propanamide;hydrochloride
CID 119269825
N-[1-[4-(diethylsulfamoyl)phenyl]ethyl]-3-(2-methylphenoxy)propanamide
CID 55338890
N-[(1S)-1-[4-(diethylsulfamoyl)phenyl]ethyl]-2-(3,4-dimethylphenyl)acetamide
CID 8802080
1-[1-(2-chlorophenyl)ethyl]-3-[1-[4-(diethylsulfamoyl)phenyl]ethyl]urea
CID 55473706

Frequently Asked Questions

What is the IUPAC name of 2-anilino-N-[1-[4-(diethylsulfamoyl)phenyl]ethyl]acetamide?
The IUPAC name of 2-anilino-N-[1-[4-(diethylsulfamoyl)phenyl]ethyl]acetamide (CID 119686819) is 2-anilino-N-[1-[4-(diethylsulfamoyl)phenyl]ethyl]acetamide.
What is the SMILES notation for 2-anilino-N-[1-[4-(diethylsulfamoyl)phenyl]ethyl]acetamide?
The canonical SMILES for 2-anilino-N-[1-[4-(diethylsulfamoyl)phenyl]ethyl]acetamide is CCN(CC)S(=O)(=O)c1ccc(C(C)NC(=O)CNc2ccccc2)cc1.
What is the InChIKey of 2-anilino-N-[1-[4-(diethylsulfamoyl)phenyl]ethyl]acetamide?
The InChIKey is XMXVELXNHJYWDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H27N3O3S/c1-4-23(5-2)27(25,26)19-13-11-17(12-14-19)16(3)22-20(24)15-21-18-9-7-6-8-10-18/h6-14,16,21H,4-5,15H2,1-3H3,(H,22,24).
What are the key properties of 2-anilino-N-[1-[4-(diethylsulfamoyl)phenyl]ethyl]acetamide?
2-anilino-N-[1-[4-(diethylsulfamoyl)phenyl]ethyl]acetamide has a molecular weight of 389.52 g/mol, XLogP of 3.01, 9 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-anilino-N-[1-[4-(diethylsulfamoyl)phenyl]ethyl]acetamide is sourced from PubChem (CID 119686819), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).