2-(thiophen-2-ylsulfonylamino)cyclopentane-1-carboxylic acid

C10H13NO4S2 — CID 64816831

IUPAC2-(thiophen-2-ylsulfonylamino)cyclopentane-1-carboxylic acid
SMILESO=C(O)C1CCCC1NS(=O)(=O)c1cccs1
InChIInChI=1S/C10H13NO4S2/c12-10(13)7-3-1-4-8(7)11-17(14,15)9-5-2-6-16-9/h2,5-8,11H,1,3-4H2,(H,12,13)
InChIKeyMKECURYCIUODFI-UHFFFAOYSA-N
MW275.35 g/mol
LogP1.28
Rot. Bonds4

About 2-(thiophen-2-ylsulfonylamino)cyclopentane-1-carboxylic acid

2-(thiophen-2-ylsulfonylamino)cyclopentane-1-carboxylic acid (PubChem CID 64816831) has the molecular formula C10H13NO4S2 and a molecular weight of 275.35 g/mol. Its IUPAC name is 2-(thiophen-2-ylsulfonylamino)cyclopentane-1-carboxylic acid.

Molecular Properties

Compound Name2-(thiophen-2-ylsulfonylamino)cyclopentane-1-carboxylic acid
PubChem CID64816831
Molecular FormulaC10H13NO4S2
Molecular Weight275.35 g/mol
Exact Mass275.03
IUPAC Name2-(thiophen-2-ylsulfonylamino)cyclopentane-1-carboxylic acid
SMILESO=C(O)C1CCCC1NS(=O)(=O)c1cccs1
InChIInChI=1S/C10H13NO4S2/c12-10(13)7-3-1-4-8(7)11-17(14,15)9-5-2-6-16-9/h2,5-8,11H,1,3-4H2,(H,12,13)
InChIKeyMKECURYCIUODFI-UHFFFAOYSA-N
XLogP1.28
TPSA83.47 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.35
LogP ≤ 51.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-aminocycloheptyl)thiophene-2-sulfonamide
CID 63258931
2-[(3,5-dimethylphenyl)sulfonylamino]cyclopentane-1-carboxylic acid
CID 64817207
2-[(4-chlorophenyl)sulfonylamino]cycloheptane-1-carboxylic acid
CID 22019722
N-(6-hydroxy-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-3-yl)thiophene-2-sulfonamide
CID 73133417
2-[(3-methylphenyl)sulfonylamino]cyclohexane-1-carboxylic acid
CID 64818390
cis-(1R,2S)-2-(2,3-dihydro-1H-inden-5-ylsulfonylamino)cyclopentane-1-carboxylic acid
CID 167750721
N-thiophen-2-ylsulfonylcyclopropanecarboxamide
CID 47232134
2-[(2-bromo-4,6-difluorophenyl)sulfonylamino]cyclopentane-1-carboxylic acid
CID 64817397
2-[(2-methylpyrazol-3-yl)sulfonylamino]cyclopentane-1-carboxylic acid
CID 104709662
N-(2-methylcyclohexyl)-2-[4-(thiophen-2-ylsulfonylamino)phenyl]acetamide
CID 42951526
(2S)-N-[(1R,2R)-2-methylcyclohexyl]-3-phenyl-2-(thiophen-2-ylsulfonylamino)propanamide
CID 124772972
2-[(5-fluoro-2-methylphenyl)sulfonylamino]cyclopentane-1-carboxylic acid
CID 64818376

Frequently Asked Questions

What is the IUPAC name of 2-(thiophen-2-ylsulfonylamino)cyclopentane-1-carboxylic acid?
The IUPAC name of 2-(thiophen-2-ylsulfonylamino)cyclopentane-1-carboxylic acid (CID 64816831) is 2-(thiophen-2-ylsulfonylamino)cyclopentane-1-carboxylic acid.
What is the SMILES notation for 2-(thiophen-2-ylsulfonylamino)cyclopentane-1-carboxylic acid?
The canonical SMILES for 2-(thiophen-2-ylsulfonylamino)cyclopentane-1-carboxylic acid is O=C(O)C1CCCC1NS(=O)(=O)c1cccs1.
What is the InChIKey of 2-(thiophen-2-ylsulfonylamino)cyclopentane-1-carboxylic acid?
The InChIKey is MKECURYCIUODFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13NO4S2/c12-10(13)7-3-1-4-8(7)11-17(14,15)9-5-2-6-16-9/h2,5-8,11H,1,3-4H2,(H,12,13).
What are the key properties of 2-(thiophen-2-ylsulfonylamino)cyclopentane-1-carboxylic acid?
2-(thiophen-2-ylsulfonylamino)cyclopentane-1-carboxylic acid has a molecular weight of 275.35 g/mol, XLogP of 1.28, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(thiophen-2-ylsulfonylamino)cyclopentane-1-carboxylic acid is sourced from PubChem (CID 64816831), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).