ethyl N-[2-(4-sulfamoylphenyl)ethyl]carbamate

C11H16N2O4S — CID 5298608

IUPACethyl N-[2-(4-sulfamoylphenyl)ethyl]carbamate
SMILESCCOC(=O)NCCc1ccc(S(N)(=O)=O)cc1
InChIInChI=1S/C11H16N2O4S/c1-2-17-11(14)13-8-7-9-3-5-10(6-4-9)18(12,15)16/h3-6H,2,7-8H2,1H3,(H,13,14)(H2,12,15,16)
InChIKeyZOZIYFMAJSPBLQ-UHFFFAOYSA-N
MW272.33 g/mol
LogP0.62
Rot. Bonds5

About ethyl N-[2-(4-sulfamoylphenyl)ethyl]carbamate

ethyl N-[2-(4-sulfamoylphenyl)ethyl]carbamate (PubChem CID 5298608) has the molecular formula C11H16N2O4S and a molecular weight of 272.33 g/mol. Its IUPAC name is ethyl N-[2-(4-sulfamoylphenyl)ethyl]carbamate.

Molecular Properties

Compound Nameethyl N-[2-(4-sulfamoylphenyl)ethyl]carbamate
PubChem CID5298608
Molecular FormulaC11H16N2O4S
Molecular Weight272.33 g/mol
Exact Mass272.08
IUPAC Nameethyl N-[2-(4-sulfamoylphenyl)ethyl]carbamate
SMILESCCOC(=O)NCCc1ccc(S(N)(=O)=O)cc1
InChIInChI=1S/C11H16N2O4S/c1-2-17-11(14)13-8-7-9-3-5-10(6-4-9)18(12,15)16/h3-6H,2,7-8H2,1H3,(H,13,14)(H2,12,15,16)
InChIKeyZOZIYFMAJSPBLQ-UHFFFAOYSA-N
XLogP0.62
TPSA98.49 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.33
LogP ≤ 50.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

Tolbutamide
CID 5505
N-[2-[4-(aminosulphonyl)phenyl]ethyl]acetamide
CID 745994
Tolbutamide Sodium
CID 23690448
N-(3-{[(4-methylphenyl)sulfonyl]amino}propyl)acetamide
CID 2186028
2-Amino-N-[2-(4-sulfamoyl-phenyl)-ethyl]-acetamide
CID 10848746
tert-butyl N-[(2R)-3-methyl-1-oxo-1-[2-(4-sulfamoylphenyl)ethylamino]butan-2-yl]carbamate
CID 168274001
ethyl 4-{[(4-cyanophenyl)sulfonyl]amino}tetrahydro-1(2H)-pyridinecarboxylate
CID 2815494
2-Propyl-pentanoic acid [2-(4-sulfamoyl-phenyl)-ethyl]-amide
CID 11099458
2-ethyl-N-[2-(4-sulfamoylphenyl)ethyl]butanamide
CID 889524
tert-butyl N-[4-oxo-4-[2-(4-sulfamoylphenyl)ethylamino]butyl]carbamate
CID 118707440
2-methoxy-N-[2-(4-sulfamoylphenyl)ethyl]acetamide
CID 798105
Methyl 4-(4-morpholinylsulfonyl)benzylcarbamate
CID 847855

Frequently Asked Questions

What is the IUPAC name of ethyl N-[2-(4-sulfamoylphenyl)ethyl]carbamate?
The IUPAC name of ethyl N-[2-(4-sulfamoylphenyl)ethyl]carbamate (CID 5298608) is ethyl N-[2-(4-sulfamoylphenyl)ethyl]carbamate.
What is the SMILES notation for ethyl N-[2-(4-sulfamoylphenyl)ethyl]carbamate?
The canonical SMILES for ethyl N-[2-(4-sulfamoylphenyl)ethyl]carbamate is CCOC(=O)NCCc1ccc(S(N)(=O)=O)cc1.
What is the InChIKey of ethyl N-[2-(4-sulfamoylphenyl)ethyl]carbamate?
The InChIKey is ZOZIYFMAJSPBLQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O4S/c1-2-17-11(14)13-8-7-9-3-5-10(6-4-9)18(12,15)16/h3-6H,2,7-8H2,1H3,(H,13,14)(H2,12,15,16).
What are the key properties of ethyl N-[2-(4-sulfamoylphenyl)ethyl]carbamate?
ethyl N-[2-(4-sulfamoylphenyl)ethyl]carbamate has a molecular weight of 272.33 g/mol, XLogP of 0.62, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl N-[2-(4-sulfamoylphenyl)ethyl]carbamate is sourced from PubChem (CID 5298608), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).