1-(2-cyclopentylethylsulfamoyl)piperidine-4-carboxylic acid

C13H24N2O4S — CID 60920685

IUPAC1-(2-cyclopentylethylsulfamoyl)piperidine-4-carboxylic acid
SMILESO=C(O)C1CCN(S(=O)(=O)NCCC2CCCC2)CC1
InChIInChI=1S/C13H24N2O4S/c16-13(17)12-6-9-15(10-7-12)20(18,19)14-8-5-11-3-1-2-4-11/h11-12,14H,1-10H2,(H,16,17)
InChIKeyHWTSYMVNXBFVEH-UHFFFAOYSA-N
MW304.41 g/mol
LogP1.20
Rot. Bonds6

About 1-(2-cyclopentylethylsulfamoyl)piperidine-4-carboxylic acid

1-(2-cyclopentylethylsulfamoyl)piperidine-4-carboxylic acid (PubChem CID 60920685) has the molecular formula C13H24N2O4S and a molecular weight of 304.41 g/mol. Its IUPAC name is 1-(2-cyclopentylethylsulfamoyl)piperidine-4-carboxylic acid.

Molecular Properties

Compound Name1-(2-cyclopentylethylsulfamoyl)piperidine-4-carboxylic acid
PubChem CID60920685
Molecular FormulaC13H24N2O4S
Molecular Weight304.41 g/mol
Exact Mass304.15
IUPAC Name1-(2-cyclopentylethylsulfamoyl)piperidine-4-carboxylic acid
SMILESO=C(O)C1CCN(S(=O)(=O)NCCC2CCCC2)CC1
InChIInChI=1S/C13H24N2O4S/c16-13(17)12-6-9-15(10-7-12)20(18,19)14-8-5-11-3-1-2-4-11/h11-12,14H,1-10H2,(H,16,17)
InChIKeyHWTSYMVNXBFVEH-UHFFFAOYSA-N
XLogP1.20
TPSA86.71 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.41
LogP ≤ 51.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2-cyclopentyloxyethylsulfamoyl)piperidine-4-carboxylic acid
CID 63827325
N-(2-cyclohexylethyl)piperazine-1-sulfonamide
CID 54932858
1-(hexylsulfamoyl)piperidine-4-carboxylic acid
CID 60858433
4-[(pyrrolidin-1-ylsulfonylamino)methyl]cyclohexane-1-carboxylic acid
CID 79525053
1-[(2-ethyl-2-hydroxybutyl)sulfamoyl]piperidine-4-carboxylic acid
CID 65105801
1-(2-cyclopentylethylsulfonyl)pyrrolidine-3-carboxylic acid
CID 122068407
1-[(2-methoxy-2-oxoethyl)sulfamoyl]piperidine-4-carboxylic acid
CID 60858730
1-[[2-(hydroxymethyl)cyclohexyl]sulfamoyl]piperidine-4-carboxylic acid
CID 106359363
1-[[2-(dimethylamino)-2-oxoethyl]sulfamoyl]piperidine-4-carboxylic acid
CID 60857789
1-(2-pyrazol-1-ylethylsulfamoyl)piperidine-4-carboxylic acid
CID 61462648
1-(2-pyridin-4-ylethylsulfamoyl)piperidine-4-carboxylic acid
CID 60913226
1-(oxolan-3-ylmethylsulfamoyl)piperidine-4-carboxylic acid
CID 54937723

Frequently Asked Questions

What is the IUPAC name of 1-(2-cyclopentylethylsulfamoyl)piperidine-4-carboxylic acid?
The IUPAC name of 1-(2-cyclopentylethylsulfamoyl)piperidine-4-carboxylic acid (CID 60920685) is 1-(2-cyclopentylethylsulfamoyl)piperidine-4-carboxylic acid.
What is the SMILES notation for 1-(2-cyclopentylethylsulfamoyl)piperidine-4-carboxylic acid?
The canonical SMILES for 1-(2-cyclopentylethylsulfamoyl)piperidine-4-carboxylic acid is O=C(O)C1CCN(S(=O)(=O)NCCC2CCCC2)CC1.
What is the InChIKey of 1-(2-cyclopentylethylsulfamoyl)piperidine-4-carboxylic acid?
The InChIKey is HWTSYMVNXBFVEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O4S/c16-13(17)12-6-9-15(10-7-12)20(18,19)14-8-5-11-3-1-2-4-11/h11-12,14H,1-10H2,(H,16,17).
What are the key properties of 1-(2-cyclopentylethylsulfamoyl)piperidine-4-carboxylic acid?
1-(2-cyclopentylethylsulfamoyl)piperidine-4-carboxylic acid has a molecular weight of 304.41 g/mol, XLogP of 1.20, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-cyclopentylethylsulfamoyl)piperidine-4-carboxylic acid is sourced from PubChem (CID 60920685), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).