2-hydroxyethyl N-(2-chloro-5-sulfamoylphenyl)carbamate

C9H11ClN2O5S — CID 79345913

IUPAC2-hydroxyethyl N-(2-chloro-5-sulfamoylphenyl)carbamate
SMILESNS(=O)(=O)c1ccc(Cl)c(NC(=O)OCCO)c1
InChIInChI=1S/C9H11ClN2O5S/c10-7-2-1-6(18(11,15)16)5-8(7)12-9(14)17-4-3-13/h1-2,5,13H,3-4H2,(H,12,14)(H2,11,15,16)
InChIKeyAJVXHTYAGGOBGF-UHFFFAOYSA-N
MW294.72 g/mol
LogP0.53
Rot. Bonds4

About 2-hydroxyethyl N-(2-chloro-5-sulfamoylphenyl)carbamate

2-hydroxyethyl N-(2-chloro-5-sulfamoylphenyl)carbamate (PubChem CID 79345913) has the molecular formula C9H11ClN2O5S and a molecular weight of 294.72 g/mol. Its IUPAC name is 2-hydroxyethyl N-(2-chloro-5-sulfamoylphenyl)carbamate.

Molecular Properties

Compound Name2-hydroxyethyl N-(2-chloro-5-sulfamoylphenyl)carbamate
PubChem CID79345913
Molecular FormulaC9H11ClN2O5S
Molecular Weight294.72 g/mol
Exact Mass294.01
IUPAC Name2-hydroxyethyl N-(2-chloro-5-sulfamoylphenyl)carbamate
SMILESNS(=O)(=O)c1ccc(Cl)c(NC(=O)OCCO)c1
InChIInChI=1S/C9H11ClN2O5S/c10-7-2-1-6(18(11,15)16)5-8(7)12-9(14)17-4-3-13/h1-2,5,13H,3-4H2,(H,12,14)(H2,11,15,16)
InChIKeyAJVXHTYAGGOBGF-UHFFFAOYSA-N
XLogP0.53
TPSA118.72 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.72
LogP ≤ 50.53
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

2-hydroxyethyl N-(2,5-dichlorophenyl)carbamate
CID 79346256
N-(2-chloro-5-sulfamoylphenyl)propanamide
CID 61130694
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CID 103022178
N-(2-chloro-5-sulfamoylphenyl)-2-ethoxyacetamide
CID 61130321
5-chloro-N-(2-chloro-5-sulfamoylphenyl)pentanamide
CID 43700521
2-amino-N-[2-(2-chloro-5-sulfamoylanilino)-2-oxoethyl]acetamide
CID 60849966
3-amino-N-(2-chloro-5-sulfamoylphenyl)butanamide
CID 54924131
N-(2-chloro-5-sulfamoylphenyl)-2-(cyclohexen-1-yl)acetamide
CID 63563292
2-[2-(2-chloro-5-sulfamoylanilino)-2-oxoethyl]sulfanylacetic acid
CID 104569457
ethyl N-(2-methyl-5-sulfamoylphenyl)carbamate
CID 61063184
2-hydroxyethyl N-(2-bromo-5-chlorophenyl)carbamate
CID 81272508
N-(2-chloro-5-sulfamoylphenyl)cyclobutanecarboxamide
CID 61131077

Frequently Asked Questions

What is the IUPAC name of 2-hydroxyethyl N-(2-chloro-5-sulfamoylphenyl)carbamate?
The IUPAC name of 2-hydroxyethyl N-(2-chloro-5-sulfamoylphenyl)carbamate (CID 79345913) is 2-hydroxyethyl N-(2-chloro-5-sulfamoylphenyl)carbamate.
What is the SMILES notation for 2-hydroxyethyl N-(2-chloro-5-sulfamoylphenyl)carbamate?
The canonical SMILES for 2-hydroxyethyl N-(2-chloro-5-sulfamoylphenyl)carbamate is NS(=O)(=O)c1ccc(Cl)c(NC(=O)OCCO)c1.
What is the InChIKey of 2-hydroxyethyl N-(2-chloro-5-sulfamoylphenyl)carbamate?
The InChIKey is AJVXHTYAGGOBGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11ClN2O5S/c10-7-2-1-6(18(11,15)16)5-8(7)12-9(14)17-4-3-13/h1-2,5,13H,3-4H2,(H,12,14)(H2,11,15,16).
What are the key properties of 2-hydroxyethyl N-(2-chloro-5-sulfamoylphenyl)carbamate?
2-hydroxyethyl N-(2-chloro-5-sulfamoylphenyl)carbamate has a molecular weight of 294.72 g/mol, XLogP of 0.53, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxyethyl N-(2-chloro-5-sulfamoylphenyl)carbamate is sourced from PubChem (CID 79345913), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).