N-(2-anilinoethyl)ethanesulfonamide

C10H16N2O2S — CID 75380743

IUPACN-(2-anilinoethyl)ethanesulfonamide
SMILESCCS(=O)(=O)NCCNc1ccccc1
InChIInChI=1S/C10H16N2O2S/c1-2-15(13,14)12-9-8-11-10-6-4-3-5-7-10/h3-7,11-12H,2,8-9H2,1H3
InChIKeyAMAWXDOQKVIFST-UHFFFAOYSA-N
MW228.32 g/mol
LogP1.04
Rot. Bonds6

About N-(2-anilinoethyl)ethanesulfonamide

N-(2-anilinoethyl)ethanesulfonamide (PubChem CID 75380743) has the molecular formula C10H16N2O2S and a molecular weight of 228.32 g/mol. Its IUPAC name is N-(2-anilinoethyl)ethanesulfonamide.

Molecular Properties

Compound NameN-(2-anilinoethyl)ethanesulfonamide
PubChem CID75380743
Molecular FormulaC10H16N2O2S
Molecular Weight228.32 g/mol
Exact Mass228.09
IUPAC NameN-(2-anilinoethyl)ethanesulfonamide
SMILESCCS(=O)(=O)NCCNc1ccccc1
InChIInChI=1S/C10H16N2O2S/c1-2-15(13,14)12-9-8-11-10-6-4-3-5-7-10/h3-7,11-12H,2,8-9H2,1H3
InChIKeyAMAWXDOQKVIFST-UHFFFAOYSA-N
XLogP1.04
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.32
LogP ≤ 51.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-(2-anilinoethyl)ethanesulfonamide?
The IUPAC name of N-(2-anilinoethyl)ethanesulfonamide (CID 75380743) is N-(2-anilinoethyl)ethanesulfonamide.
What is the SMILES notation for N-(2-anilinoethyl)ethanesulfonamide?
The canonical SMILES for N-(2-anilinoethyl)ethanesulfonamide is CCS(=O)(=O)NCCNc1ccccc1.
What is the InChIKey of N-(2-anilinoethyl)ethanesulfonamide?
The InChIKey is AMAWXDOQKVIFST-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O2S/c1-2-15(13,14)12-9-8-11-10-6-4-3-5-7-10/h3-7,11-12H,2,8-9H2,1H3.
What are the key properties of N-(2-anilinoethyl)ethanesulfonamide?
N-(2-anilinoethyl)ethanesulfonamide has a molecular weight of 228.32 g/mol, XLogP of 1.04, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-anilinoethyl)ethanesulfonamide is sourced from PubChem (CID 75380743), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).