2-cyclopent-2-en-1-yl-N-(2-methyl-3-sulfamoylphenyl)acetamide

C14H18N2O3S — CID 47337033

IUPAC2-cyclopent-2-en-1-yl-N-(2-methyl-3-sulfamoylphenyl)acetamide
SMILESCc1c(NC(=O)CC2C=CCC2)cccc1S(N)(=O)=O
InChIInChI=1S/C14H18N2O3S/c1-10-12(7-4-8-13(10)20(15,18)19)16-14(17)9-11-5-2-3-6-11/h2,4-5,7-8,11H,3,6,9H2,1H3,(H,16,17)(H2,15,18,19)
InChIKeyOZSXLZYVCZKREU-UHFFFAOYSA-N
MW294.38 g/mol
LogP1.94
Rot. Bonds4

About 2-cyclopent-2-en-1-yl-N-(2-methyl-3-sulfamoylphenyl)acetamide

2-cyclopent-2-en-1-yl-N-(2-methyl-3-sulfamoylphenyl)acetamide (PubChem CID 47337033) has the molecular formula C14H18N2O3S and a molecular weight of 294.38 g/mol. Its IUPAC name is 2-cyclopent-2-en-1-yl-N-(2-methyl-3-sulfamoylphenyl)acetamide.

Molecular Properties

Compound Name2-cyclopent-2-en-1-yl-N-(2-methyl-3-sulfamoylphenyl)acetamide
PubChem CID47337033
Molecular FormulaC14H18N2O3S
Molecular Weight294.38 g/mol
Exact Mass294.10
IUPAC Name2-cyclopent-2-en-1-yl-N-(2-methyl-3-sulfamoylphenyl)acetamide
SMILESCc1c(NC(=O)CC2C=CCC2)cccc1S(N)(=O)=O
InChIInChI=1S/C14H18N2O3S/c1-10-12(7-4-8-13(10)20(15,18)19)16-14(17)9-11-5-2-3-6-11/h2,4-5,7-8,11H,3,6,9H2,1H3,(H,16,17)(H2,15,18,19)
InChIKeyOZSXLZYVCZKREU-UHFFFAOYSA-N
XLogP1.94
TPSA89.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.38
LogP ≤ 51.94
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

2-[(1S)-cyclopent-2-en-1-yl]-N-(2-methylsulfonylphenyl)acetamide
CID 51929140
2-(cyclopentylamino)-N-(2-methyl-3-sulfamoylphenyl)acetamide
CID 60944911
N-(2-aminophenyl)-2-[(1S)-cyclopent-2-en-1-yl]acetamide
CID 51714392
N-(2-methyl-3-sulfamoylphenyl)-2-pyrrolidin-2-ylacetamide
CID 61365433
N-[2-[(2-cyclopent-2-en-1-ylacetyl)amino]phenyl]-3,4,4-trimethylpentanamide
CID 86901395
2-[(1S)-cyclopent-2-en-1-yl]-N-(4-ethyl-3-sulfamoylphenyl)acetamide
CID 94820198
2-[(1S)-cyclopent-2-en-1-yl]-N-(2,3-difluorophenyl)acetamide
CID 94813097
2-[(1R)-cyclopent-2-en-1-yl]-N-(2,3-difluorophenyl)acetamide
CID 94813098
2-cyclopent-2-en-1-yl-N-[3-(sulfamoylamino)phenyl]acetamide
CID 60728386
N-(2-bromo-3-chlorophenyl)-2-cyclopent-2-en-1-ylacetamide
CID 103479839
N-(2-bromo-4-methylphenyl)-2-[(1S)-cyclopent-2-en-1-yl]acetamide
CID 41037744
N-(2-bromo-4-methylphenyl)-2-[(1R)-cyclopent-2-en-1-yl]acetamide
CID 41037745

Frequently Asked Questions

What is the IUPAC name of 2-cyclopent-2-en-1-yl-N-(2-methyl-3-sulfamoylphenyl)acetamide?
The IUPAC name of 2-cyclopent-2-en-1-yl-N-(2-methyl-3-sulfamoylphenyl)acetamide (CID 47337033) is 2-cyclopent-2-en-1-yl-N-(2-methyl-3-sulfamoylphenyl)acetamide.
What is the SMILES notation for 2-cyclopent-2-en-1-yl-N-(2-methyl-3-sulfamoylphenyl)acetamide?
The canonical SMILES for 2-cyclopent-2-en-1-yl-N-(2-methyl-3-sulfamoylphenyl)acetamide is Cc1c(NC(=O)CC2C=CCC2)cccc1S(N)(=O)=O.
What is the InChIKey of 2-cyclopent-2-en-1-yl-N-(2-methyl-3-sulfamoylphenyl)acetamide?
The InChIKey is OZSXLZYVCZKREU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O3S/c1-10-12(7-4-8-13(10)20(15,18)19)16-14(17)9-11-5-2-3-6-11/h2,4-5,7-8,11H,3,6,9H2,1H3,(H,16,17)(H2,15,18,19).
What are the key properties of 2-cyclopent-2-en-1-yl-N-(2-methyl-3-sulfamoylphenyl)acetamide?
2-cyclopent-2-en-1-yl-N-(2-methyl-3-sulfamoylphenyl)acetamide has a molecular weight of 294.38 g/mol, XLogP of 1.94, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopent-2-en-1-yl-N-(2-methyl-3-sulfamoylphenyl)acetamide is sourced from PubChem (CID 47337033), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).