1-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]piperidine-2-carboxylic acid

C10H15N3O5S — CID 60859217

IUPAC1-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]piperidine-2-carboxylic acid
SMILESCc1cc(NS(=O)(=O)N2CCCCC2C(=O)O)no1
InChIInChI=1S/C10H15N3O5S/c1-7-6-9(11-18-7)12-19(16,17)13-5-3-2-4-8(13)10(14)15/h6,8H,2-5H2,1H3,(H,11,12)(H,14,15)
InChIKeyQOWMTKGYEJFEPV-UHFFFAOYSA-N
MW289.31 g/mol
LogP0.58
Rot. Bonds4

About 1-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]piperidine-2-carboxylic acid

1-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]piperidine-2-carboxylic acid (PubChem CID 60859217) has the molecular formula C10H15N3O5S and a molecular weight of 289.31 g/mol. Its IUPAC name is 1-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]piperidine-2-carboxylic acid.

Molecular Properties

Compound Name1-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]piperidine-2-carboxylic acid
PubChem CID60859217
Molecular FormulaC10H15N3O5S
Molecular Weight289.31 g/mol
Exact Mass289.07
IUPAC Name1-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]piperidine-2-carboxylic acid
SMILESCc1cc(NS(=O)(=O)N2CCCCC2C(=O)O)no1
InChIInChI=1S/C10H15N3O5S/c1-7-6-9(11-18-7)12-19(16,17)13-5-3-2-4-8(13)10(14)15/h6,8H,2-5H2,1H3,(H,11,12)(H,14,15)
InChIKeyQOWMTKGYEJFEPV-UHFFFAOYSA-N
XLogP0.58
TPSA112.74 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.31
LogP ≤ 50.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

1-[(4-methylphenyl)sulfamoyl]piperidine-2-carboxylic acid
CID 60859865
1-[(2-methyl-3-pyridinyl)sulfamoyl]piperidine-2-carboxylic acid
CID 79042560
1-[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxoethyl]pyrrolidine-2-carboxylic acid
CID 43441827
(2S)-1-(3,5-dimethylphenyl)sulfonylpiperidine-2-carboxylic acid
CID 66263682
1-(methoxysulfamoyl)piperidine-2-carboxylic acid
CID 64974074
(2S)-1-(tert-butylsulfamoyl)piperidine-2-carboxylic acid
CID 104977959
1-(cyclohexanecarbonyl)-N-(5-methyl-1,2-oxazol-3-yl)pyrrolidine-2-carboxamide
CID 74170922
1-[(2-bromo-5-chlorophenyl)sulfamoyl]piperidine-2-carboxylic acid
CID 81269396
1-(1,2-oxazol-5-ylmethylsulfamoyl)piperidine-2-carboxylic acid
CID 114185928
2-[2-(hydroxymethyl)piperidin-1-yl]-N-(5-methyl-1,2-oxazol-3-yl)acetamide
CID 60684790
1-(cyclopentylmethylsulfamoyl)piperidine-2-carboxylic acid
CID 60857626
2-[(5-methyl-1,2-oxazol-3-yl)carbamoyl]cyclohexane-1-carboxylic acid
CID 2862512

Frequently Asked Questions

What is the IUPAC name of 1-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]piperidine-2-carboxylic acid?
The IUPAC name of 1-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]piperidine-2-carboxylic acid (CID 60859217) is 1-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]piperidine-2-carboxylic acid.
What is the SMILES notation for 1-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]piperidine-2-carboxylic acid?
The canonical SMILES for 1-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]piperidine-2-carboxylic acid is Cc1cc(NS(=O)(=O)N2CCCCC2C(=O)O)no1.
What is the InChIKey of 1-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]piperidine-2-carboxylic acid?
The InChIKey is QOWMTKGYEJFEPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O5S/c1-7-6-9(11-18-7)12-19(16,17)13-5-3-2-4-8(13)10(14)15/h6,8H,2-5H2,1H3,(H,11,12)(H,14,15).
What are the key properties of 1-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]piperidine-2-carboxylic acid?
1-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]piperidine-2-carboxylic acid has a molecular weight of 289.31 g/mol, XLogP of 0.58, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]piperidine-2-carboxylic acid is sourced from PubChem (CID 60859217), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).