[1-(1,4-dioxaspiro[4.4]nonan-3-ylmethyl)piperidin-4-yl]methanol

C14H25NO3 — CID 62019901

IUPAC[1-(1,4-dioxaspiro[4.4]nonan-3-ylmethyl)piperidin-4-yl]methanol
SMILESOCC1CCN(CC2COC3(CCCC3)O2)CC1
InChIInChI=1S/C14H25NO3/c16-10-12-3-7-15(8-4-12)9-13-11-17-14(18-13)5-1-2-6-14/h12-13,16H,1-11H2
InChIKeyPFLSLDUXNJXZBH-UHFFFAOYSA-N
MW255.36 g/mol
LogP1.38
Rot. Bonds3

About [1-(1,4-dioxaspiro[4.4]nonan-3-ylmethyl)piperidin-4-yl]methanol

[1-(1,4-dioxaspiro[4.4]nonan-3-ylmethyl)piperidin-4-yl]methanol (PubChem CID 62019901) has the molecular formula C14H25NO3 and a molecular weight of 255.36 g/mol. Its IUPAC name is [1-(1,4-dioxaspiro[4.4]nonan-3-ylmethyl)piperidin-4-yl]methanol.

Molecular Properties

Compound Name[1-(1,4-dioxaspiro[4.4]nonan-3-ylmethyl)piperidin-4-yl]methanol
PubChem CID62019901
Molecular FormulaC14H25NO3
Molecular Weight255.36 g/mol
Exact Mass255.18
IUPAC Name[1-(1,4-dioxaspiro[4.4]nonan-3-ylmethyl)piperidin-4-yl]methanol
SMILESOCC1CCN(CC2COC3(CCCC3)O2)CC1
InChIInChI=1S/C14H25NO3/c16-10-12-3-7-15(8-4-12)9-13-11-17-14(18-13)5-1-2-6-14/h12-13,16H,1-11H2
InChIKeyPFLSLDUXNJXZBH-UHFFFAOYSA-N
XLogP1.38
TPSA41.93 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.36
LogP ≤ 51.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze [1-(1,4-dioxaspiro[4.4]nonan-3-ylmethyl)piperidin-4-yl]methanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of [1-(1,4-dioxaspiro[4.4]nonan-3-ylmethyl)piperidin-4-yl]methanol?
The IUPAC name of [1-(1,4-dioxaspiro[4.4]nonan-3-ylmethyl)piperidin-4-yl]methanol (CID 62019901) is [1-(1,4-dioxaspiro[4.4]nonan-3-ylmethyl)piperidin-4-yl]methanol.
What is the SMILES notation for [1-(1,4-dioxaspiro[4.4]nonan-3-ylmethyl)piperidin-4-yl]methanol?
The canonical SMILES for [1-(1,4-dioxaspiro[4.4]nonan-3-ylmethyl)piperidin-4-yl]methanol is OCC1CCN(CC2COC3(CCCC3)O2)CC1.
What is the InChIKey of [1-(1,4-dioxaspiro[4.4]nonan-3-ylmethyl)piperidin-4-yl]methanol?
The InChIKey is PFLSLDUXNJXZBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25NO3/c16-10-12-3-7-15(8-4-12)9-13-11-17-14(18-13)5-1-2-6-14/h12-13,16H,1-11H2.
What are the key properties of [1-(1,4-dioxaspiro[4.4]nonan-3-ylmethyl)piperidin-4-yl]methanol?
[1-(1,4-dioxaspiro[4.4]nonan-3-ylmethyl)piperidin-4-yl]methanol has a molecular weight of 255.36 g/mol, XLogP of 1.38, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(1,4-dioxaspiro[4.4]nonan-3-ylmethyl)piperidin-4-yl]methanol is sourced from PubChem (CID 62019901), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).