(3R)-1-piperidin-1-ylsulfonylpyrrolidin-3-ol

C9H18N2O3S — CID 66291550

IUPAC(3R)-1-piperidin-1-ylsulfonylpyrrolidin-3-ol
SMILESO=S(=O)(N1CCCCC1)N1CC[C@@H](O)C1
InChIInChI=1S/C9H18N2O3S/c12-9-4-7-11(8-9)15(13,14)10-5-2-1-3-6-10/h9,12H,1-8H2/t9-/m1/s1
InChIKeyFWCGUTLZHMWDHT-SECBINFHSA-N
MW234.32 g/mol
LogP-0.22
Rot. Bonds2

About (3R)-1-piperidin-1-ylsulfonylpyrrolidin-3-ol

(3R)-1-piperidin-1-ylsulfonylpyrrolidin-3-ol (PubChem CID 66291550) has the molecular formula C9H18N2O3S and a molecular weight of 234.32 g/mol. Its IUPAC name is (3R)-1-piperidin-1-ylsulfonylpyrrolidin-3-ol.

Molecular Properties

Compound Name(3R)-1-piperidin-1-ylsulfonylpyrrolidin-3-ol
PubChem CID66291550
Molecular FormulaC9H18N2O3S
Molecular Weight234.32 g/mol
Exact Mass234.10
IUPAC Name(3R)-1-piperidin-1-ylsulfonylpyrrolidin-3-ol
SMILESO=S(=O)(N1CCCCC1)N1CC[C@@H](O)C1
InChIInChI=1S/C9H18N2O3S/c12-9-4-7-11(8-9)15(13,14)10-5-2-1-3-6-10/h9,12H,1-8H2/t9-/m1/s1
InChIKeyFWCGUTLZHMWDHT-SECBINFHSA-N
XLogP-0.22
TPSA60.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.32
LogP ≤ 5-0.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (3R)-1-piperidin-1-ylsulfonylpyrrolidin-3-ol?
The IUPAC name of (3R)-1-piperidin-1-ylsulfonylpyrrolidin-3-ol (CID 66291550) is (3R)-1-piperidin-1-ylsulfonylpyrrolidin-3-ol.
What is the SMILES notation for (3R)-1-piperidin-1-ylsulfonylpyrrolidin-3-ol?
The canonical SMILES for (3R)-1-piperidin-1-ylsulfonylpyrrolidin-3-ol is O=S(=O)(N1CCCCC1)N1CC[C@@H](O)C1.
What is the InChIKey of (3R)-1-piperidin-1-ylsulfonylpyrrolidin-3-ol?
The InChIKey is FWCGUTLZHMWDHT-SECBINFHSA-N. The full InChI is InChI=1S/C9H18N2O3S/c12-9-4-7-11(8-9)15(13,14)10-5-2-1-3-6-10/h9,12H,1-8H2/t9-/m1/s1.
What are the key properties of (3R)-1-piperidin-1-ylsulfonylpyrrolidin-3-ol?
(3R)-1-piperidin-1-ylsulfonylpyrrolidin-3-ol has a molecular weight of 234.32 g/mol, XLogP of -0.22, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-1-piperidin-1-ylsulfonylpyrrolidin-3-ol is sourced from PubChem (CID 66291550), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).