4-[methyl(piperidin-4-yl)sulfamoyl]butanoic acid

C10H20N2O4S — CID 61403398

IUPAC4-[methyl(piperidin-4-yl)sulfamoyl]butanoic acid
SMILESCN(C1CCNCC1)S(=O)(=O)CCCC(=O)O
InChIInChI=1S/C10H20N2O4S/c1-12(9-4-6-11-7-5-9)17(15,16)8-2-3-10(13)14/h9,11H,2-8H2,1H3,(H,13,14)
InChIKeyFVBDUFKTMCRFFU-UHFFFAOYSA-N
MW264.35 g/mol
LogP-0.14
Rot. Bonds6

About 4-[methyl(piperidin-4-yl)sulfamoyl]butanoic acid

4-[methyl(piperidin-4-yl)sulfamoyl]butanoic acid (PubChem CID 61403398) has the molecular formula C10H20N2O4S and a molecular weight of 264.35 g/mol. Its IUPAC name is 4-[methyl(piperidin-4-yl)sulfamoyl]butanoic acid.

Molecular Properties

Compound Name4-[methyl(piperidin-4-yl)sulfamoyl]butanoic acid
PubChem CID61403398
Molecular FormulaC10H20N2O4S
Molecular Weight264.35 g/mol
Exact Mass264.11
IUPAC Name4-[methyl(piperidin-4-yl)sulfamoyl]butanoic acid
SMILESCN(C1CCNCC1)S(=O)(=O)CCCC(=O)O
InChIInChI=1S/C10H20N2O4S/c1-12(9-4-6-11-7-5-9)17(15,16)8-2-3-10(13)14/h9,11H,2-8H2,1H3,(H,13,14)
InChIKeyFVBDUFKTMCRFFU-UHFFFAOYSA-N
XLogP-0.14
TPSA86.71 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.35
LogP ≤ 5-0.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-[methyl(piperidin-4-yl)sulfamoyl]propanoic acid
CID 61403399
4-[azetidin-3-yl(methyl)sulfamoyl]butanoic acid
CID 66186641
N-methyl-N-piperidin-4-ylethanesulfonamide
CID 43606907
methyl 4-[azetidin-3-yl(methyl)sulfamoyl]butanoate
CID 66185019
4-[2-adamantyl(methyl)sulfamoyl]butanoic acid
CID 60950357
4-[ethyl(piperidin-3-yl)sulfamoyl]butanoic acid
CID 63638842
1-cyclopropyl-N-methyl-N-piperidin-4-ylmethanesulfonamide;hydrochloride
CID 119998743
4-[cyclobutylmethyl(methyl)sulfamoyl]butanoic acid
CID 62862361
4-[cyclopentyl(ethyl)sulfamoyl]butanoic acid
CID 43541031
methyl 4-[(4-ethylcyclohexyl)-methylsulfamoyl]butanoate
CID 61460515
3-[methyl(oxolan-3-yl)sulfamoyl]propanoic acid
CID 82731745
N-methyl-3-methylsulfonyl-N-piperidin-4-ylpropanamide
CID 61003895

Frequently Asked Questions

What is the IUPAC name of 4-[methyl(piperidin-4-yl)sulfamoyl]butanoic acid?
The IUPAC name of 4-[methyl(piperidin-4-yl)sulfamoyl]butanoic acid (CID 61403398) is 4-[methyl(piperidin-4-yl)sulfamoyl]butanoic acid.
What is the SMILES notation for 4-[methyl(piperidin-4-yl)sulfamoyl]butanoic acid?
The canonical SMILES for 4-[methyl(piperidin-4-yl)sulfamoyl]butanoic acid is CN(C1CCNCC1)S(=O)(=O)CCCC(=O)O.
What is the InChIKey of 4-[methyl(piperidin-4-yl)sulfamoyl]butanoic acid?
The InChIKey is FVBDUFKTMCRFFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O4S/c1-12(9-4-6-11-7-5-9)17(15,16)8-2-3-10(13)14/h9,11H,2-8H2,1H3,(H,13,14).
What are the key properties of 4-[methyl(piperidin-4-yl)sulfamoyl]butanoic acid?
4-[methyl(piperidin-4-yl)sulfamoyl]butanoic acid has a molecular weight of 264.35 g/mol, XLogP of -0.14, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[methyl(piperidin-4-yl)sulfamoyl]butanoic acid is sourced from PubChem (CID 61403398), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).