N-(2-chloro-5-sulfamoylphenyl)-2-(cyclohexen-1-yl)acetamide

C14H17ClN2O3S — CID 63563292

IUPACN-(2-chloro-5-sulfamoylphenyl)-2-(cyclohexen-1-yl)acetamide
SMILESNS(=O)(=O)c1ccc(Cl)c(NC(=O)CC2=CCCCC2)c1
InChIInChI=1S/C14H17ClN2O3S/c15-12-7-6-11(21(16,19)20)9-13(12)17-14(18)8-10-4-2-1-3-5-10/h4,6-7,9H,1-3,5,8H2,(H,17,18)(H2,16,19,20)
InChIKeyAZHQYFYSXIUWFF-UHFFFAOYSA-N
MW328.82 g/mol
LogP2.82
Rot. Bonds4

About N-(2-chloro-5-sulfamoylphenyl)-2-(cyclohexen-1-yl)acetamide

N-(2-chloro-5-sulfamoylphenyl)-2-(cyclohexen-1-yl)acetamide (PubChem CID 63563292) has the molecular formula C14H17ClN2O3S and a molecular weight of 328.82 g/mol. Its IUPAC name is N-(2-chloro-5-sulfamoylphenyl)-2-(cyclohexen-1-yl)acetamide.

Molecular Properties

Compound NameN-(2-chloro-5-sulfamoylphenyl)-2-(cyclohexen-1-yl)acetamide
PubChem CID63563292
Molecular FormulaC14H17ClN2O3S
Molecular Weight328.82 g/mol
Exact Mass328.06
IUPAC NameN-(2-chloro-5-sulfamoylphenyl)-2-(cyclohexen-1-yl)acetamide
SMILESNS(=O)(=O)c1ccc(Cl)c(NC(=O)CC2=CCCCC2)c1
InChIInChI=1S/C14H17ClN2O3S/c15-12-7-6-11(21(16,19)20)9-13(12)17-14(18)8-10-4-2-1-3-5-10/h4,6-7,9H,1-3,5,8H2,(H,17,18)(H2,16,19,20)
InChIKeyAZHQYFYSXIUWFF-UHFFFAOYSA-N
XLogP2.82
TPSA89.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.82
LogP ≤ 52.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

N-(2-chloro-5-sulfamoylphenyl)propanamide
CID 61130694
N-(2-chloro-4-hydroxyphenyl)-2-(cyclohexen-1-yl)acetamide
CID 64786368
N-(2-chloro-5-sulfamoylphenyl)-2-cyclohexylacetamide
CID 61130512
2-[2-(2-chloro-5-sulfamoylanilino)-2-oxoethyl]sulfanylacetic acid
CID 104569457
N-(2-bromo-5-chloro-4-methylphenyl)-2-(cyclohexen-1-yl)acetamide
CID 113445578
2-hydroxyethyl N-(2-chloro-5-sulfamoylphenyl)carbamate
CID 79345913
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)-3-(propan-2-ylamino)propanamide
CID 60852732
1-(aminomethyl)-N-(2-chloro-5-sulfamoylphenyl)cyclobutane-1-carboxamide
CID 115447750
N-(2-chloro-5-sulfamoylphenyl)-2-ethoxyacetamide
CID 61130321

Frequently Asked Questions

What is the IUPAC name of N-(2-chloro-5-sulfamoylphenyl)-2-(cyclohexen-1-yl)acetamide?
The IUPAC name of N-(2-chloro-5-sulfamoylphenyl)-2-(cyclohexen-1-yl)acetamide (CID 63563292) is N-(2-chloro-5-sulfamoylphenyl)-2-(cyclohexen-1-yl)acetamide.
What is the SMILES notation for N-(2-chloro-5-sulfamoylphenyl)-2-(cyclohexen-1-yl)acetamide?
The canonical SMILES for N-(2-chloro-5-sulfamoylphenyl)-2-(cyclohexen-1-yl)acetamide is NS(=O)(=O)c1ccc(Cl)c(NC(=O)CC2=CCCCC2)c1.
What is the InChIKey of N-(2-chloro-5-sulfamoylphenyl)-2-(cyclohexen-1-yl)acetamide?
The InChIKey is AZHQYFYSXIUWFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17ClN2O3S/c15-12-7-6-11(21(16,19)20)9-13(12)17-14(18)8-10-4-2-1-3-5-10/h4,6-7,9H,1-3,5,8H2,(H,17,18)(H2,16,19,20).
What are the key properties of N-(2-chloro-5-sulfamoylphenyl)-2-(cyclohexen-1-yl)acetamide?
N-(2-chloro-5-sulfamoylphenyl)-2-(cyclohexen-1-yl)acetamide has a molecular weight of 328.82 g/mol, XLogP of 2.82, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-chloro-5-sulfamoylphenyl)-2-(cyclohexen-1-yl)acetamide is sourced from PubChem (CID 63563292), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).