4-cyclopentyloxy-N-[(2R)-2-phenyl-2-thiophen-2-ylsulfonylethyl]benzenesulfonamide

C23H25NO5S3 — CID 51662791

IUPAC4-cyclopentyloxy-N-[(2R)-2-phenyl-2-thiophen-2-ylsulfonylethyl]benzenesulfonamide
SMILESO=S(=O)(NC[C@@H](c1ccccc1)S(=O)(=O)c1cccs1)c1ccc(OC2CCCC2)cc1
InChIInChI=1S/C23H25NO5S3/c25-31(26,23-11-6-16-30-23)22(18-7-2-1-3-8-18)17-24-32(27,28)21-14-12-20(13-15-21)29-19-9-4-5-10-19/h1-3,6-8,11-16,19,22,24H,4-5,9-10,17H2/t22-/m0/s1
InChIKeyVZFHIQRXPQXKGT-QFIPXVFZSA-N
MW491.66 g/mol
LogP4.56
Rot. Bonds9

About 4-cyclopentyloxy-N-[(2R)-2-phenyl-2-thiophen-2-ylsulfonylethyl]benzenesulfonamide

4-cyclopentyloxy-N-[(2R)-2-phenyl-2-thiophen-2-ylsulfonylethyl]benzenesulfonamide (PubChem CID 51662791) has the molecular formula C23H25NO5S3 and a molecular weight of 491.66 g/mol. Its IUPAC name is 4-cyclopentyloxy-N-[(2R)-2-phenyl-2-thiophen-2-ylsulfonylethyl]benzenesulfonamide.

Molecular Properties

Compound Name4-cyclopentyloxy-N-[(2R)-2-phenyl-2-thiophen-2-ylsulfonylethyl]benzenesulfonamide
PubChem CID51662791
Molecular FormulaC23H25NO5S3
Molecular Weight491.66 g/mol
Exact Mass491.09
IUPAC Name4-cyclopentyloxy-N-[(2R)-2-phenyl-2-thiophen-2-ylsulfonylethyl]benzenesulfonamide
SMILESO=S(=O)(NC[C@@H](c1ccccc1)S(=O)(=O)c1cccs1)c1ccc(OC2CCCC2)cc1
InChIInChI=1S/C23H25NO5S3/c25-31(26,23-11-6-16-30-23)22(18-7-2-1-3-8-18)17-24-32(27,28)21-14-12-20(13-15-21)29-19-9-4-5-10-19/h1-3,6-8,11-16,19,22,24H,4-5,9-10,17H2/t22-/m0/s1
InChIKeyVZFHIQRXPQXKGT-QFIPXVFZSA-N
XLogP4.56
TPSA89.54 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds9
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500491.66
LogP ≤ 54.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

4-tert-butyl-N-[(2R)-2-phenyl-2-thiophen-2-ylsulfonylethyl]benzenesulfonamide
CID 51662803
N-[(2S)-2-phenyl-2-thiophen-2-ylsulfonylethyl]-5,6,7,8-tetrahydronaphthalene-2-sulfonamide
CID 51662774
3,4-dimethoxy-N-[(2S)-2-phenyl-2-thiophen-2-ylsulfonylethyl]benzenesulfonamide
CID 51453352
2-chloro-N-[(2R)-2-phenyl-2-thiophen-2-ylsulfonylethyl]benzenesulfonamide
CID 51662811
4-propan-2-yloxy-N-(2-pyridin-3-yl-2-thiophen-2-ylsulfonylethyl)benzenesulfonamide
CID 21007549
N-(ethylsulfamoyl)-2-phenyl-2-thiophen-2-ylsulfonylethanamine
CID 110605719
4-ethyl-N-[2-(4-fluorophenyl)-2-thiophen-2-ylsulfonylethyl]benzenesulfonamide
CID 50753608
N-[(2S)-2-(furan-2-yl)-2-thiophen-2-ylsulfonylethyl]-4-phenylbenzenesulfonamide
CID 41193256
4-methyl-N-(2-pyridin-3-yl-2-thiophen-2-ylsulfonylethyl)benzenesulfonamide
CID 20995693
4-methyl-N-[(2R)-2-pyridin-3-yl-2-thiophen-2-ylsulfonylethyl]benzenesulfonamide
CID 40903607
N-(2-phenyl-2-thiophen-2-ylsulfonylethyl)benzamide
CID 44649043
2-phenoxy-N-[(2S)-2-phenyl-2-thiophen-2-ylsulfonylethyl]acetamide
CID 9180474

Frequently Asked Questions

What is the IUPAC name of 4-cyclopentyloxy-N-[(2R)-2-phenyl-2-thiophen-2-ylsulfonylethyl]benzenesulfonamide?
The IUPAC name of 4-cyclopentyloxy-N-[(2R)-2-phenyl-2-thiophen-2-ylsulfonylethyl]benzenesulfonamide (CID 51662791) is 4-cyclopentyloxy-N-[(2R)-2-phenyl-2-thiophen-2-ylsulfonylethyl]benzenesulfonamide.
What is the SMILES notation for 4-cyclopentyloxy-N-[(2R)-2-phenyl-2-thiophen-2-ylsulfonylethyl]benzenesulfonamide?
The canonical SMILES for 4-cyclopentyloxy-N-[(2R)-2-phenyl-2-thiophen-2-ylsulfonylethyl]benzenesulfonamide is O=S(=O)(NC[C@@H](c1ccccc1)S(=O)(=O)c1cccs1)c1ccc(OC2CCCC2)cc1.
What is the InChIKey of 4-cyclopentyloxy-N-[(2R)-2-phenyl-2-thiophen-2-ylsulfonylethyl]benzenesulfonamide?
The InChIKey is VZFHIQRXPQXKGT-QFIPXVFZSA-N. The full InChI is InChI=1S/C23H25NO5S3/c25-31(26,23-11-6-16-30-23)22(18-7-2-1-3-8-18)17-24-32(27,28)21-14-12-20(13-15-21)29-19-9-4-5-10-19/h1-3,6-8,11-16,19,22,24H,4-5,9-10,17H2/t22-/m0/s1.
What are the key properties of 4-cyclopentyloxy-N-[(2R)-2-phenyl-2-thiophen-2-ylsulfonylethyl]benzenesulfonamide?
4-cyclopentyloxy-N-[(2R)-2-phenyl-2-thiophen-2-ylsulfonylethyl]benzenesulfonamide has a molecular weight of 491.66 g/mol, XLogP of 4.56, 9 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclopentyloxy-N-[(2R)-2-phenyl-2-thiophen-2-ylsulfonylethyl]benzenesulfonamide is sourced from PubChem (CID 51662791), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).