2-[(1R)-cyclopent-2-en-1-yl]-N-[2-(thiophen-2-ylsulfonylamino)phenyl]acetamide

C17H18N2O3S2 — CID 30900728

IUPAC2-[(1R)-cyclopent-2-en-1-yl]-N-[2-(thiophen-2-ylsulfonylamino)phenyl]acetamide
SMILESO=C(C[C@@H]1C=CCC1)Nc1ccccc1NS(=O)(=O)c1cccs1
InChIInChI=1S/C17H18N2O3S2/c20-16(12-13-6-1-2-7-13)18-14-8-3-4-9-15(14)19-24(21,22)17-10-5-11-23-17/h1,3-6,8-11,13,19H,2,7,12H2,(H,18,20)/t13-/m1/s1
InChIKeyNFJPMFAYWNTATI-CYBMUJFWSA-N
MW362.48 g/mol
LogP3.84
Rot. Bonds6

About 2-[(1R)-cyclopent-2-en-1-yl]-N-[2-(thiophen-2-ylsulfonylamino)phenyl]acetamide

2-[(1R)-cyclopent-2-en-1-yl]-N-[2-(thiophen-2-ylsulfonylamino)phenyl]acetamide (PubChem CID 30900728) has the molecular formula C17H18N2O3S2 and a molecular weight of 362.48 g/mol. Its IUPAC name is 2-[(1R)-cyclopent-2-en-1-yl]-N-[2-(thiophen-2-ylsulfonylamino)phenyl]acetamide.

Molecular Properties

Compound Name2-[(1R)-cyclopent-2-en-1-yl]-N-[2-(thiophen-2-ylsulfonylamino)phenyl]acetamide
PubChem CID30900728
Molecular FormulaC17H18N2O3S2
Molecular Weight362.48 g/mol
Exact Mass362.08
IUPAC Name2-[(1R)-cyclopent-2-en-1-yl]-N-[2-(thiophen-2-ylsulfonylamino)phenyl]acetamide
SMILESO=C(C[C@@H]1C=CCC1)Nc1ccccc1NS(=O)(=O)c1cccs1
InChIInChI=1S/C17H18N2O3S2/c20-16(12-13-6-1-2-7-13)18-14-8-3-4-9-15(14)19-24(21,22)17-10-5-11-23-17/h1,3-6,8-11,13,19H,2,7,12H2,(H,18,20)/t13-/m1/s1
InChIKeyNFJPMFAYWNTATI-CYBMUJFWSA-N
XLogP3.84
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.48
LogP ≤ 53.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-[2-[(2-cyclopent-2-en-1-ylacetyl)amino]phenyl]-3,4,4-trimethylpentanamide
CID 86901395
N-[3-[(2-chlorophenyl)sulfamoyl]phenyl]-2-[(1S)-cyclopent-2-en-1-yl]acetamide
CID 9068938
2-cyclopent-2-en-1-yl-N-[2-(methylaminomethyl)phenyl]acetamide
CID 43600979
(1R,6R)-6-[[2-(thiophen-2-ylsulfonylamino)phenyl]carbamoyl]cyclohex-3-ene-1-carboxylic acid
CID 25391540
2-[(1S)-cyclopent-2-en-1-yl]-N-(2,3-difluorophenyl)acetamide
CID 94813097
N-[2-[(2-cyclopent-2-en-1-ylacetyl)amino]phenyl]hexa-2,4-dienamide
CID 72688727
2-(thiophen-2-ylsulfonylamino)benzamide
CID 769135
2-(2-acetyl-1H-isoquinolin-1-yl)-N-[2-(thiophen-2-ylsulfonylamino)phenyl]acetamide
CID 43067104
2-(2-chlorophenoxy)-N-[2-(thiophen-2-ylsulfonylamino)phenyl]acetamide
CID 38869455
(1R,2S,3S,4R)-3-[[2-(thiophen-2-ylsulfonylamino)phenyl]carbamoyl]bicyclo[2.2.1]hept-5-ene-2-carboxylic acid
CID 98336656
N-(2-bromo-3-chlorophenyl)-2-cyclopent-2-en-1-ylacetamide
CID 103479839
N-[2-[[acetyl(methyl)amino]methyl]phenyl]-2-cyclopent-2-en-1-ylacetamide
CID 46403346

Frequently Asked Questions

What is the IUPAC name of 2-[(1R)-cyclopent-2-en-1-yl]-N-[2-(thiophen-2-ylsulfonylamino)phenyl]acetamide?
The IUPAC name of 2-[(1R)-cyclopent-2-en-1-yl]-N-[2-(thiophen-2-ylsulfonylamino)phenyl]acetamide (CID 30900728) is 2-[(1R)-cyclopent-2-en-1-yl]-N-[2-(thiophen-2-ylsulfonylamino)phenyl]acetamide.
What is the SMILES notation for 2-[(1R)-cyclopent-2-en-1-yl]-N-[2-(thiophen-2-ylsulfonylamino)phenyl]acetamide?
The canonical SMILES for 2-[(1R)-cyclopent-2-en-1-yl]-N-[2-(thiophen-2-ylsulfonylamino)phenyl]acetamide is O=C(C[C@@H]1C=CCC1)Nc1ccccc1NS(=O)(=O)c1cccs1.
What is the InChIKey of 2-[(1R)-cyclopent-2-en-1-yl]-N-[2-(thiophen-2-ylsulfonylamino)phenyl]acetamide?
The InChIKey is NFJPMFAYWNTATI-CYBMUJFWSA-N. The full InChI is InChI=1S/C17H18N2O3S2/c20-16(12-13-6-1-2-7-13)18-14-8-3-4-9-15(14)19-24(21,22)17-10-5-11-23-17/h1,3-6,8-11,13,19H,2,7,12H2,(H,18,20)/t13-/m1/s1.
What are the key properties of 2-[(1R)-cyclopent-2-en-1-yl]-N-[2-(thiophen-2-ylsulfonylamino)phenyl]acetamide?
2-[(1R)-cyclopent-2-en-1-yl]-N-[2-(thiophen-2-ylsulfonylamino)phenyl]acetamide has a molecular weight of 362.48 g/mol, XLogP of 3.84, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(1R)-cyclopent-2-en-1-yl]-N-[2-(thiophen-2-ylsulfonylamino)phenyl]acetamide is sourced from PubChem (CID 30900728), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).