1-(3-hydroxycyclobutyl)piperidin-4-ol

C9H17NO2 — CID 67281324

IUPAC1-(3-hydroxycyclobutyl)piperidin-4-ol
SMILESOC1CCN(C2CC(O)C2)CC1
InChIInChI=1S/C9H17NO2/c11-8-1-3-10(4-2-8)7-5-9(12)6-7/h7-9,11-12H,1-6H2
InChIKeyADESFEVPWXPTAY-UHFFFAOYSA-N
MW171.24 g/mol
LogP-0.03
Rot. Bonds1

About 1-(3-hydroxycyclobutyl)piperidin-4-ol

1-(3-hydroxycyclobutyl)piperidin-4-ol (PubChem CID 67281324) has the molecular formula C9H17NO2 and a molecular weight of 171.24 g/mol. Its IUPAC name is 1-(3-hydroxycyclobutyl)piperidin-4-ol.

Molecular Properties

Compound Name1-(3-hydroxycyclobutyl)piperidin-4-ol
PubChem CID67281324
Molecular FormulaC9H17NO2
Molecular Weight171.24 g/mol
Exact Mass171.13
IUPAC Name1-(3-hydroxycyclobutyl)piperidin-4-ol
SMILESOC1CCN(C2CC(O)C2)CC1
InChIInChI=1S/C9H17NO2/c11-8-1-3-10(4-2-8)7-5-9(12)6-7/h7-9,11-12H,1-6H2
InChIKeyADESFEVPWXPTAY-UHFFFAOYSA-N
XLogP-0.03
TPSA43.70 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.24
LogP ≤ 5-0.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(3-hydroxycyclobutyl)piperidin-4-ol?
The IUPAC name of 1-(3-hydroxycyclobutyl)piperidin-4-ol (CID 67281324) is 1-(3-hydroxycyclobutyl)piperidin-4-ol.
What is the SMILES notation for 1-(3-hydroxycyclobutyl)piperidin-4-ol?
The canonical SMILES for 1-(3-hydroxycyclobutyl)piperidin-4-ol is OC1CCN(C2CC(O)C2)CC1.
What is the InChIKey of 1-(3-hydroxycyclobutyl)piperidin-4-ol?
The InChIKey is ADESFEVPWXPTAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17NO2/c11-8-1-3-10(4-2-8)7-5-9(12)6-7/h7-9,11-12H,1-6H2.
What are the key properties of 1-(3-hydroxycyclobutyl)piperidin-4-ol?
1-(3-hydroxycyclobutyl)piperidin-4-ol has a molecular weight of 171.24 g/mol, XLogP of -0.03, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-hydroxycyclobutyl)piperidin-4-ol is sourced from PubChem (CID 67281324), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).