1-[[(2R)-1-hydroxypropan-2-yl]sulfamoyl]piperidine-2-carboxylic acid

C9H18N2O5S — CID 107215422

IUPAC1-[[(2R)-1-hydroxypropan-2-yl]sulfamoyl]piperidine-2-carboxylic acid
SMILESC[C@H](CO)NS(=O)(=O)N1CCCCC1C(=O)O
InChIInChI=1S/C9H18N2O5S/c1-7(6-12)10-17(15,16)11-5-3-2-4-8(11)9(13)14/h7-8,10,12H,2-6H2,1H3,(H,13,14)/t7-,8?/m1/s1
InChIKeyMMIWMWLFCQIMML-GVHYBUMESA-N
MW266.32 g/mol
LogP-0.86
Rot. Bonds5

About 1-[[(2R)-1-hydroxypropan-2-yl]sulfamoyl]piperidine-2-carboxylic acid

1-[[(2R)-1-hydroxypropan-2-yl]sulfamoyl]piperidine-2-carboxylic acid (PubChem CID 107215422) has the molecular formula C9H18N2O5S and a molecular weight of 266.32 g/mol. Its IUPAC name is 1-[[(2R)-1-hydroxypropan-2-yl]sulfamoyl]piperidine-2-carboxylic acid.

Molecular Properties

Compound Name1-[[(2R)-1-hydroxypropan-2-yl]sulfamoyl]piperidine-2-carboxylic acid
PubChem CID107215422
Molecular FormulaC9H18N2O5S
Molecular Weight266.32 g/mol
Exact Mass266.09
IUPAC Name1-[[(2R)-1-hydroxypropan-2-yl]sulfamoyl]piperidine-2-carboxylic acid
SMILESC[C@H](CO)NS(=O)(=O)N1CCCCC1C(=O)O
InChIInChI=1S/C9H18N2O5S/c1-7(6-12)10-17(15,16)11-5-3-2-4-8(11)9(13)14/h7-8,10,12H,2-6H2,1H3,(H,13,14)/t7-,8?/m1/s1
InChIKeyMMIWMWLFCQIMML-GVHYBUMESA-N
XLogP-0.86
TPSA106.94 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.32
LogP ≤ 5-0.86
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

1-(pentan-2-ylsulfamoyl)piperidine-2-carboxylic acid
CID 60859071
1-[(1-methoxy-1-oxopropan-2-yl)sulfamoyl]piperidine-2-carboxylic acid
CID 60859270
1-[(1-methoxy-3-methyl-1-oxobutan-2-yl)sulfamoyl]piperidine-2-carboxylic acid
CID 60857629
1-(2,3,3-trimethylbutylsulfamoyl)piperidine-2-carboxylic acid
CID 83141758
1-[[1-hydroxy-2-(hydroxymethyl)butan-2-yl]sulfamoyl]piperidine-2-carboxylic acid
CID 107864789
1-(4-hydroxypentylsulfamoyl)piperidine-2-carboxylic acid
CID 106120554
(2S)-1-(tert-butylsulfamoyl)piperidine-2-carboxylic acid
CID 104977959
1-(methoxysulfamoyl)piperidine-2-carboxylic acid
CID 64974074
1-(cyclopentylmethylsulfamoyl)piperidine-2-carboxylic acid
CID 60857626
1-(2-methylsulfonylethylsulfamoyl)piperidine-2-carboxylic acid
CID 54931954
1-(butylsulfamoyl)piperidine-2-carboxylic acid
CID 60857762
1-(cyclopropylsulfamoyl)azepane-2-carboxylic acid
CID 114533609

Frequently Asked Questions

What is the IUPAC name of 1-[[(2R)-1-hydroxypropan-2-yl]sulfamoyl]piperidine-2-carboxylic acid?
The IUPAC name of 1-[[(2R)-1-hydroxypropan-2-yl]sulfamoyl]piperidine-2-carboxylic acid (CID 107215422) is 1-[[(2R)-1-hydroxypropan-2-yl]sulfamoyl]piperidine-2-carboxylic acid.
What is the SMILES notation for 1-[[(2R)-1-hydroxypropan-2-yl]sulfamoyl]piperidine-2-carboxylic acid?
The canonical SMILES for 1-[[(2R)-1-hydroxypropan-2-yl]sulfamoyl]piperidine-2-carboxylic acid is C[C@H](CO)NS(=O)(=O)N1CCCCC1C(=O)O.
What is the InChIKey of 1-[[(2R)-1-hydroxypropan-2-yl]sulfamoyl]piperidine-2-carboxylic acid?
The InChIKey is MMIWMWLFCQIMML-GVHYBUMESA-N. The full InChI is InChI=1S/C9H18N2O5S/c1-7(6-12)10-17(15,16)11-5-3-2-4-8(11)9(13)14/h7-8,10,12H,2-6H2,1H3,(H,13,14)/t7-,8?/m1/s1.
What are the key properties of 1-[[(2R)-1-hydroxypropan-2-yl]sulfamoyl]piperidine-2-carboxylic acid?
1-[[(2R)-1-hydroxypropan-2-yl]sulfamoyl]piperidine-2-carboxylic acid has a molecular weight of 266.32 g/mol, XLogP of -0.86, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[[(2R)-1-hydroxypropan-2-yl]sulfamoyl]piperidine-2-carboxylic acid is sourced from PubChem (CID 107215422), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).