2-(3-chlorophenyl)-N-(3-sulfamoylpropyl)acetamide

C11H15ClN2O3S — CID 62505682

IUPAC2-(3-chlorophenyl)-N-(3-sulfamoylpropyl)acetamide
SMILESNS(=O)(=O)CCCNC(=O)Cc1cccc(Cl)c1
InChIInChI=1S/C11H15ClN2O3S/c12-10-4-1-3-9(7-10)8-11(15)14-5-2-6-18(13,16)17/h1,3-4,7H,2,5-6,8H2,(H,14,15)(H2,13,16,17)
InChIKeyCALDQLYDUWDDNA-UHFFFAOYSA-N
MW290.77 g/mol
LogP0.68
Rot. Bonds6

About 2-(3-chlorophenyl)-N-(3-sulfamoylpropyl)acetamide

2-(3-chlorophenyl)-N-(3-sulfamoylpropyl)acetamide (PubChem CID 62505682) has the molecular formula C11H15ClN2O3S and a molecular weight of 290.77 g/mol. Its IUPAC name is 2-(3-chlorophenyl)-N-(3-sulfamoylpropyl)acetamide.

Molecular Properties

Compound Name2-(3-chlorophenyl)-N-(3-sulfamoylpropyl)acetamide
PubChem CID62505682
Molecular FormulaC11H15ClN2O3S
Molecular Weight290.77 g/mol
Exact Mass290.05
IUPAC Name2-(3-chlorophenyl)-N-(3-sulfamoylpropyl)acetamide
SMILESNS(=O)(=O)CCCNC(=O)Cc1cccc(Cl)c1
InChIInChI=1S/C11H15ClN2O3S/c12-10-4-1-3-9(7-10)8-11(15)14-5-2-6-18(13,16)17/h1,3-4,7H,2,5-6,8H2,(H,14,15)(H2,13,16,17)
InChIKeyCALDQLYDUWDDNA-UHFFFAOYSA-N
XLogP0.68
TPSA89.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.77
LogP ≤ 50.68
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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Related Compounds

2-(3-methylphenyl)-N-(3-sulfamoylpropyl)acetamide
CID 62388737
N-(2-aminoethyl)-2-(3-chlorophenyl)acetamide;hydrochloride
CID 119385267
2-(3-chlorophenyl)-N-(3-pyrrol-1-ylpropyl)acetamide
CID 110721086
2-(3-aminophenyl)-N-(2-sulfamoylethyl)acetamide
CID 55084090
2-(3-aminophenyl)-N-(3-methylsulfonylpropyl)acetamide
CID 62500011
N-(3-aminopropyl)-2-[3-[(3-chlorophenyl)methoxy]phenyl]acetamide
CID 119405733
N-[2-[[2-(3-chlorophenyl)acetyl]amino]ethyl]-2,2,2-trifluoroacetamide
CID 108932591
2-(3-chlorophenyl)-N-[2-(ethylamino)ethyl]acetamide;hydrochloride
CID 119509114
2-[2-(aminomethyl)phenyl]-N-[2-(3-chlorophenyl)ethyl]acetamide
CID 81313061
N-[2-(2-chloroethoxy)ethyl]-2-(3-chlorophenyl)acetamide
CID 114297493
N-[(4-aminophenyl)methyl]-2-(3-chlorophenyl)acetamide
CID 62503389
2-[3-[(3-chlorophenyl)methylsulfonyl]propanoylamino]ethyl-dimethylazanium
CID 4139237

Frequently Asked Questions

What is the IUPAC name of 2-(3-chlorophenyl)-N-(3-sulfamoylpropyl)acetamide?
The IUPAC name of 2-(3-chlorophenyl)-N-(3-sulfamoylpropyl)acetamide (CID 62505682) is 2-(3-chlorophenyl)-N-(3-sulfamoylpropyl)acetamide.
What is the SMILES notation for 2-(3-chlorophenyl)-N-(3-sulfamoylpropyl)acetamide?
The canonical SMILES for 2-(3-chlorophenyl)-N-(3-sulfamoylpropyl)acetamide is NS(=O)(=O)CCCNC(=O)Cc1cccc(Cl)c1.
What is the InChIKey of 2-(3-chlorophenyl)-N-(3-sulfamoylpropyl)acetamide?
The InChIKey is CALDQLYDUWDDNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15ClN2O3S/c12-10-4-1-3-9(7-10)8-11(15)14-5-2-6-18(13,16)17/h1,3-4,7H,2,5-6,8H2,(H,14,15)(H2,13,16,17).
What are the key properties of 2-(3-chlorophenyl)-N-(3-sulfamoylpropyl)acetamide?
2-(3-chlorophenyl)-N-(3-sulfamoylpropyl)acetamide has a molecular weight of 290.77 g/mol, XLogP of 0.68, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-chlorophenyl)-N-(3-sulfamoylpropyl)acetamide is sourced from PubChem (CID 62505682), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).