(3R)-1-propan-2-ylsulfonylpiperidin-3-ol

C8H17NO3S — CID 129365650

IUPAC(3R)-1-propan-2-ylsulfonylpiperidin-3-ol
SMILESCC(C)S(=O)(=O)N1CCC[C@@H](O)C1
InChIInChI=1S/C8H17NO3S/c1-7(2)13(11,12)9-5-3-4-8(10)6-9/h7-8,10H,3-6H2,1-2H3/t8-/m1/s1
InChIKeyHLZWCUBCDXJTHP-MRVPVSSYSA-N
MW207.29 g/mol
LogP0.18
Rot. Bonds2

About (3R)-1-propan-2-ylsulfonylpiperidin-3-ol

(3R)-1-propan-2-ylsulfonylpiperidin-3-ol (PubChem CID 129365650) has the molecular formula C8H17NO3S and a molecular weight of 207.29 g/mol. Its IUPAC name is (3R)-1-propan-2-ylsulfonylpiperidin-3-ol.

Molecular Properties

Compound Name(3R)-1-propan-2-ylsulfonylpiperidin-3-ol
PubChem CID129365650
Molecular FormulaC8H17NO3S
Molecular Weight207.29 g/mol
Exact Mass207.09
IUPAC Name(3R)-1-propan-2-ylsulfonylpiperidin-3-ol
SMILESCC(C)S(=O)(=O)N1CCC[C@@H](O)C1
InChIInChI=1S/C8H17NO3S/c1-7(2)13(11,12)9-5-3-4-8(10)6-9/h7-8,10H,3-6H2,1-2H3/t8-/m1/s1
InChIKeyHLZWCUBCDXJTHP-MRVPVSSYSA-N
XLogP0.18
TPSA57.61 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.29
LogP ≤ 50.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-Methanesulfonylpiperidin-3-ol
CID 17918031
1-(1-Piperidinylsulfonyl)propan-2-ol
CID 119056772
1-(1-Piperidinylsulfonyl)butan-2-ol
CID 129875292
(3S,4S)-1-butylsulfonylpiperidine-3,4-diol
CID 56900402
(1S)-1-[1-(2-cyclopropylethylsulfonyl)piperidin-4-yl]ethanol
CID 164639391
5,5-Dimethyl-1-methylsulfonylpiperidin-3-ol
CID 135055639
1-(4,4,4-Trifluorobutylsulfonyl)piperidin-3-ol
CID 83059563
(3S)-1-(4,4,4-trifluorobutylsulfonyl)piperidin-3-ol
CID 107225039
1-[1-(3-Fluoropropylsulfonyl)piperidin-2-yl]ethanol
CID 109866065
1-(3-Fluoropropylsulfonyl)-4-methylpiperidin-3-ol
CID 109948468
4-Methyl-1-(4,4,4-trifluorobutylsulfonyl)piperidin-3-ol
CID 113356104
2-(3-Fluoro-2-hydroxypropyl)-6-methyl-1lambda6,2-thiazinane-1,1-dione
CID 165587292

Frequently Asked Questions

What is the IUPAC name of (3R)-1-propan-2-ylsulfonylpiperidin-3-ol?
The IUPAC name of (3R)-1-propan-2-ylsulfonylpiperidin-3-ol (CID 129365650) is (3R)-1-propan-2-ylsulfonylpiperidin-3-ol.
What is the SMILES notation for (3R)-1-propan-2-ylsulfonylpiperidin-3-ol?
The canonical SMILES for (3R)-1-propan-2-ylsulfonylpiperidin-3-ol is CC(C)S(=O)(=O)N1CCC[C@@H](O)C1.
What is the InChIKey of (3R)-1-propan-2-ylsulfonylpiperidin-3-ol?
The InChIKey is HLZWCUBCDXJTHP-MRVPVSSYSA-N. The full InChI is InChI=1S/C8H17NO3S/c1-7(2)13(11,12)9-5-3-4-8(10)6-9/h7-8,10H,3-6H2,1-2H3/t8-/m1/s1.
What are the key properties of (3R)-1-propan-2-ylsulfonylpiperidin-3-ol?
(3R)-1-propan-2-ylsulfonylpiperidin-3-ol has a molecular weight of 207.29 g/mol, XLogP of 0.18, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-1-propan-2-ylsulfonylpiperidin-3-ol is sourced from PubChem (CID 129365650), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).