N-[2-(5-chloro-2-sulfamoylphenyl)ethyl]acetamide

C10H13ClN2O3S — CID 118162125

IUPACN-[2-(5-chloro-2-sulfamoylphenyl)ethyl]acetamide
SMILESCC(=O)NCCc1cc(Cl)ccc1S(N)(=O)=O
InChIInChI=1S/C10H13ClN2O3S/c1-7(14)13-5-4-8-6-9(11)2-3-10(8)17(12,15)16/h2-3,6H,4-5H2,1H3,(H,13,14)(H2,12,15,16)
InChIKeyUQBIWOGZRAEDME-UHFFFAOYSA-N
MW276.75 g/mol
LogP0.67
Rot. Bonds4

About N-[2-(5-chloro-2-sulfamoylphenyl)ethyl]acetamide

N-[2-(5-chloro-2-sulfamoylphenyl)ethyl]acetamide (PubChem CID 118162125) has the molecular formula C10H13ClN2O3S and a molecular weight of 276.75 g/mol. Its IUPAC name is N-[2-(5-chloro-2-sulfamoylphenyl)ethyl]acetamide.

Molecular Properties

Compound NameN-[2-(5-chloro-2-sulfamoylphenyl)ethyl]acetamide
PubChem CID118162125
Molecular FormulaC10H13ClN2O3S
Molecular Weight276.75 g/mol
Exact Mass276.03
IUPAC NameN-[2-(5-chloro-2-sulfamoylphenyl)ethyl]acetamide
SMILESCC(=O)NCCc1cc(Cl)ccc1S(N)(=O)=O
InChIInChI=1S/C10H13ClN2O3S/c1-7(14)13-5-4-8-6-9(11)2-3-10(8)17(12,15)16/h2-3,6H,4-5H2,1H3,(H,13,14)(H2,12,15,16)
InChIKeyUQBIWOGZRAEDME-UHFFFAOYSA-N
XLogP0.67
TPSA89.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.75
LogP ≤ 50.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-chloro-2-[2-(methanesulfonamido)ethyl]benzenesulfonic acid
CID 54148909
N-[2-(4-methoxy-3-sulfamoylphenyl)ethyl]acetamide
CID 71757647
N-[2-[2-(aminomethyl)-4-chlorophenyl]ethyl]-3,3-dimethylbutanamide
CID 142162671
N-[2-[(2,4-dichlorophenyl)methylamino]ethyl]acetamide
CID 28684550
1-amino-3-[2-(5-chloro-2-fluorophenyl)ethyl]urea
CID 115192937
4-acetyl-2-propylbenzenesulfonamide
CID 73012694
N-[2-[5-(2-chloroacetyl)-2-fluorophenyl]ethyl]acetamide
CID 71755478
5-chloro-2-(methylamino)benzenesulfonamide
CID 44590431
2-(aminomethyl)-4-chloro-N-methylbenzenesulfonamide;hydrochloride
CID 66877918
1-(2-butyl-4-chlorophenyl)sulfonyl-1-methyl-3-propylurea
CID 142008839
[2-(2-acetamidoethyl)phenyl]-(4-chlorophenyl)iodanium
CID 62707379
3-amino-N-[2-(2,4-dichlorophenyl)ethyl]-2,2-dimethylpropanamide
CID 81484637

Frequently Asked Questions

What is the IUPAC name of N-[2-(5-chloro-2-sulfamoylphenyl)ethyl]acetamide?
The IUPAC name of N-[2-(5-chloro-2-sulfamoylphenyl)ethyl]acetamide (CID 118162125) is N-[2-(5-chloro-2-sulfamoylphenyl)ethyl]acetamide.
What is the SMILES notation for N-[2-(5-chloro-2-sulfamoylphenyl)ethyl]acetamide?
The canonical SMILES for N-[2-(5-chloro-2-sulfamoylphenyl)ethyl]acetamide is CC(=O)NCCc1cc(Cl)ccc1S(N)(=O)=O.
What is the InChIKey of N-[2-(5-chloro-2-sulfamoylphenyl)ethyl]acetamide?
The InChIKey is UQBIWOGZRAEDME-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13ClN2O3S/c1-7(14)13-5-4-8-6-9(11)2-3-10(8)17(12,15)16/h2-3,6H,4-5H2,1H3,(H,13,14)(H2,12,15,16).
What are the key properties of N-[2-(5-chloro-2-sulfamoylphenyl)ethyl]acetamide?
N-[2-(5-chloro-2-sulfamoylphenyl)ethyl]acetamide has a molecular weight of 276.75 g/mol, XLogP of 0.67, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(5-chloro-2-sulfamoylphenyl)ethyl]acetamide is sourced from PubChem (CID 118162125), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).