1-[cyclopropyl(ethyl)sulfamoyl]piperidine-2-carboxylic acid

C11H20N2O4S — CID 60859892

IUPAC1-[cyclopropyl(ethyl)sulfamoyl]piperidine-2-carboxylic acid
SMILESCCN(C1CC1)S(=O)(=O)N1CCCCC1C(=O)O
InChIInChI=1S/C11H20N2O4S/c1-2-12(9-6-7-9)18(16,17)13-8-4-3-5-10(13)11(14)15/h9-10H,2-8H2,1H3,(H,14,15)
InChIKeyVYZNOCFIAWRVQA-UHFFFAOYSA-N
MW276.36 g/mol
LogP0.65
Rot. Bonds5

About 1-[cyclopropyl(ethyl)sulfamoyl]piperidine-2-carboxylic acid

1-[cyclopropyl(ethyl)sulfamoyl]piperidine-2-carboxylic acid (PubChem CID 60859892) has the molecular formula C11H20N2O4S and a molecular weight of 276.36 g/mol. Its IUPAC name is 1-[cyclopropyl(ethyl)sulfamoyl]piperidine-2-carboxylic acid.

Molecular Properties

Compound Name1-[cyclopropyl(ethyl)sulfamoyl]piperidine-2-carboxylic acid
PubChem CID60859892
Molecular FormulaC11H20N2O4S
Molecular Weight276.36 g/mol
Exact Mass276.11
IUPAC Name1-[cyclopropyl(ethyl)sulfamoyl]piperidine-2-carboxylic acid
SMILESCCN(C1CC1)S(=O)(=O)N1CCCCC1C(=O)O
InChIInChI=1S/C11H20N2O4S/c1-2-12(9-6-7-9)18(16,17)13-8-4-3-5-10(13)11(14)15/h9-10H,2-8H2,1H3,(H,14,15)
InChIKeyVYZNOCFIAWRVQA-UHFFFAOYSA-N
XLogP0.65
TPSA77.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.36
LogP ≤ 50.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(dimethylsulfamoyl)azepane-2-carboxylic acid
CID 64561301
1-[ethyl(2-methylprop-2-enyl)sulfamoyl]piperidine-2-carboxylic acid
CID 60857926
1-[cyclopropyl(ethyl)sulfamoyl]piperidine-3-carboxylic acid
CID 60859891
1-[ethyl-[2-(methylamino)-2-oxoethyl]sulfamoyl]piperidine-2-carboxylic acid
CID 60858940
1-[3-hydroxypropyl(methyl)sulfamoyl]piperidine-2-carboxylic acid
CID 114230140
1-[methyl(2-methylsulfonylethyl)sulfamoyl]piperidine-2-carboxylic acid
CID 79849932
1-[methyl(oxan-4-yl)sulfamoyl]piperidine-2-carboxylic acid
CID 60858619
1-[2-methoxyethyl(oxan-4-yl)sulfamoyl]pyrrolidine-2-carboxylic acid
CID 154780562
1-[bis(cyanomethyl)sulfamoyl]piperidine-2-carboxylic acid
CID 60857593
1-[bis(prop-2-enyl)sulfamoyl]piperidine-2-carboxylic acid
CID 60857764
1-[methyl(3-methylbutyl)sulfamoyl]piperidine-2-carboxylic acid
CID 55028848
(2R)-1-[butyl(methyl)sulfamoyl]pyrrolidine-2-carboxylic acid
CID 78923008

Frequently Asked Questions

What is the IUPAC name of 1-[cyclopropyl(ethyl)sulfamoyl]piperidine-2-carboxylic acid?
The IUPAC name of 1-[cyclopropyl(ethyl)sulfamoyl]piperidine-2-carboxylic acid (CID 60859892) is 1-[cyclopropyl(ethyl)sulfamoyl]piperidine-2-carboxylic acid.
What is the SMILES notation for 1-[cyclopropyl(ethyl)sulfamoyl]piperidine-2-carboxylic acid?
The canonical SMILES for 1-[cyclopropyl(ethyl)sulfamoyl]piperidine-2-carboxylic acid is CCN(C1CC1)S(=O)(=O)N1CCCCC1C(=O)O.
What is the InChIKey of 1-[cyclopropyl(ethyl)sulfamoyl]piperidine-2-carboxylic acid?
The InChIKey is VYZNOCFIAWRVQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O4S/c1-2-12(9-6-7-9)18(16,17)13-8-4-3-5-10(13)11(14)15/h9-10H,2-8H2,1H3,(H,14,15).
What are the key properties of 1-[cyclopropyl(ethyl)sulfamoyl]piperidine-2-carboxylic acid?
1-[cyclopropyl(ethyl)sulfamoyl]piperidine-2-carboxylic acid has a molecular weight of 276.36 g/mol, XLogP of 0.65, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[cyclopropyl(ethyl)sulfamoyl]piperidine-2-carboxylic acid is sourced from PubChem (CID 60859892), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).