N-[4-(ethylsulfonylamino)phenyl]-2-(methylamino)acetamide

C11H17N3O3S — CID 54863090

IUPACN-[4-(ethylsulfonylamino)phenyl]-2-(methylamino)acetamide
SMILESCCS(=O)(=O)Nc1ccc(NC(=O)CNC)cc1
InChIInChI=1S/C11H17N3O3S/c1-3-18(16,17)14-10-6-4-9(5-7-10)13-11(15)8-12-2/h4-7,12,14H,3,8H2,1-2H3,(H,13,15)
InChIKeyYITIXIHXNIWKTQ-UHFFFAOYSA-N
MW271.34 g/mol
LogP0.61
Rot. Bonds6

About N-[4-(ethylsulfonylamino)phenyl]-2-(methylamino)acetamide

N-[4-(ethylsulfonylamino)phenyl]-2-(methylamino)acetamide (PubChem CID 54863090) has the molecular formula C11H17N3O3S and a molecular weight of 271.34 g/mol. Its IUPAC name is N-[4-(ethylsulfonylamino)phenyl]-2-(methylamino)acetamide.

Molecular Properties

Compound NameN-[4-(ethylsulfonylamino)phenyl]-2-(methylamino)acetamide
PubChem CID54863090
Molecular FormulaC11H17N3O3S
Molecular Weight271.34 g/mol
Exact Mass271.10
IUPAC NameN-[4-(ethylsulfonylamino)phenyl]-2-(methylamino)acetamide
SMILESCCS(=O)(=O)Nc1ccc(NC(=O)CNC)cc1
InChIInChI=1S/C11H17N3O3S/c1-3-18(16,17)14-10-6-4-9(5-7-10)13-11(15)8-12-2/h4-7,12,14H,3,8H2,1-2H3,(H,13,15)
InChIKeyYITIXIHXNIWKTQ-UHFFFAOYSA-N
XLogP0.61
TPSA87.30 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.34
LogP ≤ 50.61
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-[4-(butylsulfonylamino)phenyl]-2-(methylamino)acetamide;hydrochloride
CID 119800492
2-bromo-N-[4-(ethylsulfonylamino)phenyl]acetamide
CID 63679707
2-(cyclopropylamino)-N-[4-(ethylsulfonylamino)phenyl]acetamide
CID 60945147
3-bromo-N-[4-(ethylsulfonylamino)phenyl]propanamide
CID 113385211
N-[4-(ethylsulfonylamino)phenyl]-2-(2-methoxyethylamino)acetamide
CID 79272393
2-[2-[4-(ethylsulfonylamino)anilino]-2-oxoethoxy]acetic acid
CID 61329012
2-(methylamino)-N-(4-propan-2-ylsulfonylphenyl)acetamide
CID 96678961
6-amino-N-[4-(ethylsulfonylamino)phenyl]hexanamide
CID 60944515
2-(methylamino)-N-[4-(4-methylphenoxy)phenyl]acetamide
CID 18084877
2-ethyl-N-[4-(ethylsulfonylamino)phenyl]butanamide
CID 47353320
2,4-dichloro-N-[2-[4-(ethylsulfonylamino)anilino]-2-oxoethyl]benzamide
CID 55959694
2-chloro-N-[4-(ethylsulfonylamino)phenyl]propanamide
CID 54867179

Frequently Asked Questions

What is the IUPAC name of N-[4-(ethylsulfonylamino)phenyl]-2-(methylamino)acetamide?
The IUPAC name of N-[4-(ethylsulfonylamino)phenyl]-2-(methylamino)acetamide (CID 54863090) is N-[4-(ethylsulfonylamino)phenyl]-2-(methylamino)acetamide.
What is the SMILES notation for N-[4-(ethylsulfonylamino)phenyl]-2-(methylamino)acetamide?
The canonical SMILES for N-[4-(ethylsulfonylamino)phenyl]-2-(methylamino)acetamide is CCS(=O)(=O)Nc1ccc(NC(=O)CNC)cc1.
What is the InChIKey of N-[4-(ethylsulfonylamino)phenyl]-2-(methylamino)acetamide?
The InChIKey is YITIXIHXNIWKTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O3S/c1-3-18(16,17)14-10-6-4-9(5-7-10)13-11(15)8-12-2/h4-7,12,14H,3,8H2,1-2H3,(H,13,15).
What are the key properties of N-[4-(ethylsulfonylamino)phenyl]-2-(methylamino)acetamide?
N-[4-(ethylsulfonylamino)phenyl]-2-(methylamino)acetamide has a molecular weight of 271.34 g/mol, XLogP of 0.61, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(ethylsulfonylamino)phenyl]-2-(methylamino)acetamide is sourced from PubChem (CID 54863090), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).