(1-piperidin-3-ylsulfonylpiperidin-3-yl)methanol

C11H22N2O3S — CID 43590545

IUPAC(1-piperidin-3-ylsulfonylpiperidin-3-yl)methanol
SMILESO=S(=O)(C1CCCNC1)N1CCCC(CO)C1
InChIInChI=1S/C11H22N2O3S/c14-9-10-3-2-6-13(8-10)17(15,16)11-4-1-5-12-7-11/h10-12,14H,1-9H2
InChIKeyRMAPEACGINKERG-UHFFFAOYSA-N
MW262.37 g/mol
LogP-0.23
Rot. Bonds3

About (1-piperidin-3-ylsulfonylpiperidin-3-yl)methanol

(1-piperidin-3-ylsulfonylpiperidin-3-yl)methanol (PubChem CID 43590545) has the molecular formula C11H22N2O3S and a molecular weight of 262.37 g/mol. Its IUPAC name is (1-piperidin-3-ylsulfonylpiperidin-3-yl)methanol.

Molecular Properties

Compound Name(1-piperidin-3-ylsulfonylpiperidin-3-yl)methanol
PubChem CID43590545
Molecular FormulaC11H22N2O3S
Molecular Weight262.37 g/mol
Exact Mass262.14
IUPAC Name(1-piperidin-3-ylsulfonylpiperidin-3-yl)methanol
SMILESO=S(=O)(C1CCCNC1)N1CCCC(CO)C1
InChIInChI=1S/C11H22N2O3S/c14-9-10-3-2-6-13(8-10)17(15,16)11-4-1-5-12-7-11/h10-12,14H,1-9H2
InChIKeyRMAPEACGINKERG-UHFFFAOYSA-N
XLogP-0.23
TPSA69.64 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.37
LogP ≤ 5-0.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (1-piperidin-3-ylsulfonylpiperidin-3-yl)methanol?
The IUPAC name of (1-piperidin-3-ylsulfonylpiperidin-3-yl)methanol (CID 43590545) is (1-piperidin-3-ylsulfonylpiperidin-3-yl)methanol.
What is the SMILES notation for (1-piperidin-3-ylsulfonylpiperidin-3-yl)methanol?
The canonical SMILES for (1-piperidin-3-ylsulfonylpiperidin-3-yl)methanol is O=S(=O)(C1CCCNC1)N1CCCC(CO)C1.
What is the InChIKey of (1-piperidin-3-ylsulfonylpiperidin-3-yl)methanol?
The InChIKey is RMAPEACGINKERG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O3S/c14-9-10-3-2-6-13(8-10)17(15,16)11-4-1-5-12-7-11/h10-12,14H,1-9H2.
What are the key properties of (1-piperidin-3-ylsulfonylpiperidin-3-yl)methanol?
(1-piperidin-3-ylsulfonylpiperidin-3-yl)methanol has a molecular weight of 262.37 g/mol, XLogP of -0.23, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (1-piperidin-3-ylsulfonylpiperidin-3-yl)methanol is sourced from PubChem (CID 43590545), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).