3-[2-(1,3-dioxolan-2-yl)piperidin-1-yl]propan-1-ol

C11H21NO3 — CID 56526941

IUPAC3-[2-(1,3-dioxolan-2-yl)piperidin-1-yl]propan-1-ol
SMILESOCCCN1CCCCC1C1OCCO1
InChIInChI=1S/C11H21NO3/c13-7-3-6-12-5-2-1-4-10(12)11-14-8-9-15-11/h10-11,13H,1-9H2
InChIKeyWUDKDNLWMZGFHO-UHFFFAOYSA-N
MW215.29 g/mol
LogP0.60
Rot. Bonds4

About 3-[2-(1,3-dioxolan-2-yl)piperidin-1-yl]propan-1-ol

3-[2-(1,3-dioxolan-2-yl)piperidin-1-yl]propan-1-ol (PubChem CID 56526941) has the molecular formula C11H21NO3 and a molecular weight of 215.29 g/mol. Its IUPAC name is 3-[2-(1,3-dioxolan-2-yl)piperidin-1-yl]propan-1-ol.

Molecular Properties

Compound Name3-[2-(1,3-dioxolan-2-yl)piperidin-1-yl]propan-1-ol
PubChem CID56526941
Molecular FormulaC11H21NO3
Molecular Weight215.29 g/mol
Exact Mass215.15
IUPAC Name3-[2-(1,3-dioxolan-2-yl)piperidin-1-yl]propan-1-ol
SMILESOCCCN1CCCCC1C1OCCO1
InChIInChI=1S/C11H21NO3/c13-7-3-6-12-5-2-1-4-10(12)11-14-8-9-15-11/h10-11,13H,1-9H2
InChIKeyWUDKDNLWMZGFHO-UHFFFAOYSA-N
XLogP0.60
TPSA41.93 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.29
LogP ≤ 50.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-[2-(1,3-dioxolan-2-yl)piperidin-1-yl]propan-1-ol?
The IUPAC name of 3-[2-(1,3-dioxolan-2-yl)piperidin-1-yl]propan-1-ol (CID 56526941) is 3-[2-(1,3-dioxolan-2-yl)piperidin-1-yl]propan-1-ol.
What is the SMILES notation for 3-[2-(1,3-dioxolan-2-yl)piperidin-1-yl]propan-1-ol?
The canonical SMILES for 3-[2-(1,3-dioxolan-2-yl)piperidin-1-yl]propan-1-ol is OCCCN1CCCCC1C1OCCO1.
What is the InChIKey of 3-[2-(1,3-dioxolan-2-yl)piperidin-1-yl]propan-1-ol?
The InChIKey is WUDKDNLWMZGFHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO3/c13-7-3-6-12-5-2-1-4-10(12)11-14-8-9-15-11/h10-11,13H,1-9H2.
What are the key properties of 3-[2-(1,3-dioxolan-2-yl)piperidin-1-yl]propan-1-ol?
3-[2-(1,3-dioxolan-2-yl)piperidin-1-yl]propan-1-ol has a molecular weight of 215.29 g/mol, XLogP of 0.60, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-(1,3-dioxolan-2-yl)piperidin-1-yl]propan-1-ol is sourced from PubChem (CID 56526941), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).