2-hydroxyethyl N-[2-(ethylsulfamoyl)phenyl]carbamate

C11H16N2O5S — CID 79345271

IUPAC2-hydroxyethyl N-[2-(ethylsulfamoyl)phenyl]carbamate
SMILESCCNS(=O)(=O)c1ccccc1NC(=O)OCCO
InChIInChI=1S/C11H16N2O5S/c1-2-12-19(16,17)10-6-4-3-5-9(10)13-11(15)18-8-7-14/h3-6,12,14H,2,7-8H2,1H3,(H,13,15)
InChIKeyKCIMMYCIVUZOTQ-UHFFFAOYSA-N
MW288.33 g/mol
LogP0.53
Rot. Bonds6

About 2-hydroxyethyl N-[2-(ethylsulfamoyl)phenyl]carbamate

2-hydroxyethyl N-[2-(ethylsulfamoyl)phenyl]carbamate (PubChem CID 79345271) has the molecular formula C11H16N2O5S and a molecular weight of 288.33 g/mol. Its IUPAC name is 2-hydroxyethyl N-[2-(ethylsulfamoyl)phenyl]carbamate.

Molecular Properties

Compound Name2-hydroxyethyl N-[2-(ethylsulfamoyl)phenyl]carbamate
PubChem CID79345271
Molecular FormulaC11H16N2O5S
Molecular Weight288.33 g/mol
Exact Mass288.08
IUPAC Name2-hydroxyethyl N-[2-(ethylsulfamoyl)phenyl]carbamate
SMILESCCNS(=O)(=O)c1ccccc1NC(=O)OCCO
InChIInChI=1S/C11H16N2O5S/c1-2-12-19(16,17)10-6-4-3-5-9(10)13-11(15)18-8-7-14/h3-6,12,14H,2,7-8H2,1H3,(H,13,15)
InChIKeyKCIMMYCIVUZOTQ-UHFFFAOYSA-N
XLogP0.53
TPSA104.73 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.33
LogP ≤ 50.53
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-hydroxyethyl N-[2-(ethylsulfamoyl)phenyl]carbamate?
The IUPAC name of 2-hydroxyethyl N-[2-(ethylsulfamoyl)phenyl]carbamate (CID 79345271) is 2-hydroxyethyl N-[2-(ethylsulfamoyl)phenyl]carbamate.
What is the SMILES notation for 2-hydroxyethyl N-[2-(ethylsulfamoyl)phenyl]carbamate?
The canonical SMILES for 2-hydroxyethyl N-[2-(ethylsulfamoyl)phenyl]carbamate is CCNS(=O)(=O)c1ccccc1NC(=O)OCCO.
What is the InChIKey of 2-hydroxyethyl N-[2-(ethylsulfamoyl)phenyl]carbamate?
The InChIKey is KCIMMYCIVUZOTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O5S/c1-2-12-19(16,17)10-6-4-3-5-9(10)13-11(15)18-8-7-14/h3-6,12,14H,2,7-8H2,1H3,(H,13,15).
What are the key properties of 2-hydroxyethyl N-[2-(ethylsulfamoyl)phenyl]carbamate?
2-hydroxyethyl N-[2-(ethylsulfamoyl)phenyl]carbamate has a molecular weight of 288.33 g/mol, XLogP of 0.53, 6 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxyethyl N-[2-(ethylsulfamoyl)phenyl]carbamate is sourced from PubChem (CID 79345271), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).