1-(cyclopentylmethylsulfamoyl)piperidine-2-carboxylic acid

C12H22N2O4S — CID 60857626

IUPAC1-(cyclopentylmethylsulfamoyl)piperidine-2-carboxylic acid
SMILESO=C(O)C1CCCCN1S(=O)(=O)NCC1CCCC1
InChIInChI=1S/C12H22N2O4S/c15-12(16)11-7-3-4-8-14(11)19(17,18)13-9-10-5-1-2-6-10/h10-11,13H,1-9H2,(H,15,16)
InChIKeyHKPHLXHKVRHURS-UHFFFAOYSA-N
MW290.38 g/mol
LogP0.95
Rot. Bonds5

About 1-(cyclopentylmethylsulfamoyl)piperidine-2-carboxylic acid

1-(cyclopentylmethylsulfamoyl)piperidine-2-carboxylic acid (PubChem CID 60857626) has the molecular formula C12H22N2O4S and a molecular weight of 290.38 g/mol. Its IUPAC name is 1-(cyclopentylmethylsulfamoyl)piperidine-2-carboxylic acid.

Molecular Properties

Compound Name1-(cyclopentylmethylsulfamoyl)piperidine-2-carboxylic acid
PubChem CID60857626
Molecular FormulaC12H22N2O4S
Molecular Weight290.38 g/mol
Exact Mass290.13
IUPAC Name1-(cyclopentylmethylsulfamoyl)piperidine-2-carboxylic acid
SMILESO=C(O)C1CCCCN1S(=O)(=O)NCC1CCCC1
InChIInChI=1S/C12H22N2O4S/c15-12(16)11-7-3-4-8-14(11)19(17,18)13-9-10-5-1-2-6-10/h10-11,13H,1-9H2,(H,15,16)
InChIKeyHKPHLXHKVRHURS-UHFFFAOYSA-N
XLogP0.95
TPSA86.71 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.38
LogP ≤ 50.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 1-(cyclopentylmethylsulfamoyl)piperidine-2-carboxylic acid with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(oxan-4-ylmethylsulfamoyl)piperidine-2-carboxylic acid
CID 63711167
1-[2-(carbamoylamino)ethylsulfamoyl]piperidine-2-carboxylic acid
CID 83116927
1-(2-methylsulfonylethylsulfamoyl)piperidine-2-carboxylic acid
CID 54931954
1-(butylsulfamoyl)piperidine-2-carboxylic acid
CID 60857762
1-[[2-(dimethylamino)-2-oxoethyl]sulfamoyl]piperidine-2-carboxylic acid
CID 60857946
1-(pentylsulfamoyl)piperidine-2-carboxylic acid
CID 60857759
1-[3-(methylamino)propylsulfamoyl]piperidine-2-carboxylic acid
CID 61403826
1-(2,2-diethoxyethylsulfamoyl)piperidine-2-carboxylic acid
CID 79538538
1-(methoxysulfamoyl)piperidine-2-carboxylic acid
CID 64974074
1-[(2-methyl-2-methylsulfonylpropyl)sulfamoyl]piperidine-2-carboxylic acid
CID 79561600
1-[(4-bromophenyl)methylsulfamoyl]piperidine-2-carboxylic acid
CID 60859548
1-[[3-(dimethylamino)-3-oxopropyl]sulfamoyl]piperidine-2-carboxylic acid
CID 60926710

Frequently Asked Questions

What is the IUPAC name of 1-(cyclopentylmethylsulfamoyl)piperidine-2-carboxylic acid?
The IUPAC name of 1-(cyclopentylmethylsulfamoyl)piperidine-2-carboxylic acid (CID 60857626) is 1-(cyclopentylmethylsulfamoyl)piperidine-2-carboxylic acid.
What is the SMILES notation for 1-(cyclopentylmethylsulfamoyl)piperidine-2-carboxylic acid?
The canonical SMILES for 1-(cyclopentylmethylsulfamoyl)piperidine-2-carboxylic acid is O=C(O)C1CCCCN1S(=O)(=O)NCC1CCCC1.
What is the InChIKey of 1-(cyclopentylmethylsulfamoyl)piperidine-2-carboxylic acid?
The InChIKey is HKPHLXHKVRHURS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N2O4S/c15-12(16)11-7-3-4-8-14(11)19(17,18)13-9-10-5-1-2-6-10/h10-11,13H,1-9H2,(H,15,16).
What are the key properties of 1-(cyclopentylmethylsulfamoyl)piperidine-2-carboxylic acid?
1-(cyclopentylmethylsulfamoyl)piperidine-2-carboxylic acid has a molecular weight of 290.38 g/mol, XLogP of 0.95, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cyclopentylmethylsulfamoyl)piperidine-2-carboxylic acid is sourced from PubChem (CID 60857626), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).