1-piperidin-4-ylazetidin-3-ol

C8H16N2O — CID 52988114

IUPAC1-piperidin-4-ylazetidin-3-ol
SMILESOC1CN(C2CCNCC2)C1
InChIInChI=1S/C8H16N2O/c11-8-5-10(6-8)7-1-3-9-4-2-7/h7-9,11H,1-6H2
InChIKeyMHCWBHMMWDDZFI-UHFFFAOYSA-N
MW156.23 g/mol
LogP-0.59
Rot. Bonds1

About 1-piperidin-4-ylazetidin-3-ol

1-piperidin-4-ylazetidin-3-ol (PubChem CID 52988114) has the molecular formula C8H16N2O and a molecular weight of 156.23 g/mol. Its IUPAC name is 1-piperidin-4-ylazetidin-3-ol.

Molecular Properties

Compound Name1-piperidin-4-ylazetidin-3-ol
PubChem CID52988114
Molecular FormulaC8H16N2O
Molecular Weight156.23 g/mol
Exact Mass156.13
IUPAC Name1-piperidin-4-ylazetidin-3-ol
SMILESOC1CN(C2CCNCC2)C1
InChIInChI=1S/C8H16N2O/c11-8-5-10(6-8)7-1-3-9-4-2-7/h7-9,11H,1-6H2
InChIKeyMHCWBHMMWDDZFI-UHFFFAOYSA-N
XLogP-0.59
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.23
LogP ≤ 5-0.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-piperidin-4-ylazetidin-3-ol?
The IUPAC name of 1-piperidin-4-ylazetidin-3-ol (CID 52988114) is 1-piperidin-4-ylazetidin-3-ol.
What is the SMILES notation for 1-piperidin-4-ylazetidin-3-ol?
The canonical SMILES for 1-piperidin-4-ylazetidin-3-ol is OC1CN(C2CCNCC2)C1.
What is the InChIKey of 1-piperidin-4-ylazetidin-3-ol?
The InChIKey is MHCWBHMMWDDZFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N2O/c11-8-5-10(6-8)7-1-3-9-4-2-7/h7-9,11H,1-6H2.
What are the key properties of 1-piperidin-4-ylazetidin-3-ol?
1-piperidin-4-ylazetidin-3-ol has a molecular weight of 156.23 g/mol, XLogP of -0.59, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-piperidin-4-ylazetidin-3-ol is sourced from PubChem (CID 52988114), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).