N-[2-[[2-(methylamino)phenyl]sulfonylamino]ethyl]acetamide

C11H17N3O3S — CID 55043683

IUPACN-[2-[[2-(methylamino)phenyl]sulfonylamino]ethyl]acetamide
SMILESCNc1ccccc1S(=O)(=O)NCCNC(C)=O
InChIInChI=1S/C11H17N3O3S/c1-9(15)13-7-8-14-18(16,17)11-6-4-3-5-10(11)12-2/h3-6,12,14H,7-8H2,1-2H3,(H,13,15)
InChIKeyLKIBKZVWIMGOBI-UHFFFAOYSA-N
MW271.34 g/mol
LogP0.14
Rot. Bonds6

About N-[2-[[2-(methylamino)phenyl]sulfonylamino]ethyl]acetamide

N-[2-[[2-(methylamino)phenyl]sulfonylamino]ethyl]acetamide (PubChem CID 55043683) has the molecular formula C11H17N3O3S and a molecular weight of 271.34 g/mol. Its IUPAC name is N-[2-[[2-(methylamino)phenyl]sulfonylamino]ethyl]acetamide.

Molecular Properties

Compound NameN-[2-[[2-(methylamino)phenyl]sulfonylamino]ethyl]acetamide
PubChem CID55043683
Molecular FormulaC11H17N3O3S
Molecular Weight271.34 g/mol
Exact Mass271.10
IUPAC NameN-[2-[[2-(methylamino)phenyl]sulfonylamino]ethyl]acetamide
SMILESCNc1ccccc1S(=O)(=O)NCCNC(C)=O
InChIInChI=1S/C11H17N3O3S/c1-9(15)13-7-8-14-18(16,17)11-6-4-3-5-10(11)12-2/h3-6,12,14H,7-8H2,1-2H3,(H,13,15)
InChIKeyLKIBKZVWIMGOBI-UHFFFAOYSA-N
XLogP0.14
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 ≤ 50.14
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-[2-[[2-(methylamino)-4-nitrophenyl]sulfonylamino]ethyl]acetamide
CID 62147494
2-(methylamino)-N-[2-(methylsulfamoyl)ethyl]benzenesulfonamide
CID 106342257
N-[2-[(3-chloro-2-methylphenyl)sulfonylamino]ethyl]acetamide
CID 39621833
3-(2-acetamidoethylsulfamoyl)-2-methylbenzoic acid
CID 63742484
2-(methylamino)-N-(3-phenylpropyl)benzenesulfonamide
CID 62145986
N-[2-[(2-amino-3-pyridinyl)sulfonylamino]ethyl]acetamide
CID 62146437
2-(methylamino)-N-(4,4,4-trifluorobutyl)benzenesulfonamide
CID 115522029
2-(methylamino)-N-[2-[methyl(propan-2-yl)amino]ethyl]benzenesulfonamide
CID 62640214
N-[2-[(2,4-dimethylphenyl)sulfonylamino]ethyl]acetamide
CID 31391784
2-[(2-methylphenyl)sulfonylamino]ethylurea
CID 83118355
N-[2-[[4-(methylamino)-3-nitrophenyl]sulfonylamino]ethyl]acetamide
CID 62147495
N-[2-[(4-methylsulfonylphenyl)sulfonylamino]ethyl]acetamide
CID 110759438

Frequently Asked Questions

What is the IUPAC name of N-[2-[[2-(methylamino)phenyl]sulfonylamino]ethyl]acetamide?
The IUPAC name of N-[2-[[2-(methylamino)phenyl]sulfonylamino]ethyl]acetamide (CID 55043683) is N-[2-[[2-(methylamino)phenyl]sulfonylamino]ethyl]acetamide.
What is the SMILES notation for N-[2-[[2-(methylamino)phenyl]sulfonylamino]ethyl]acetamide?
The canonical SMILES for N-[2-[[2-(methylamino)phenyl]sulfonylamino]ethyl]acetamide is CNc1ccccc1S(=O)(=O)NCCNC(C)=O.
What is the InChIKey of N-[2-[[2-(methylamino)phenyl]sulfonylamino]ethyl]acetamide?
The InChIKey is LKIBKZVWIMGOBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O3S/c1-9(15)13-7-8-14-18(16,17)11-6-4-3-5-10(11)12-2/h3-6,12,14H,7-8H2,1-2H3,(H,13,15).
What are the key properties of N-[2-[[2-(methylamino)phenyl]sulfonylamino]ethyl]acetamide?
N-[2-[[2-(methylamino)phenyl]sulfonylamino]ethyl]acetamide has a molecular weight of 271.34 g/mol, XLogP of 0.14, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[[2-(methylamino)phenyl]sulfonylamino]ethyl]acetamide is sourced from PubChem (CID 55043683), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).