4-(4-fluoropiperidin-1-yl)oxolan-3-ol

C9H16FNO2 — CID 126856877

IUPAC4-(4-fluoropiperidin-1-yl)oxolan-3-ol
SMILESOC1COCC1N1CCC(F)CC1
InChIInChI=1S/C9H16FNO2/c10-7-1-3-11(4-2-7)8-5-13-6-9(8)12/h7-9,12H,1-6H2
InChIKeyPVDSXAZDIROSSE-UHFFFAOYSA-N
MW189.23 g/mol
LogP0.18
Rot. Bonds1

About 4-(4-fluoropiperidin-1-yl)oxolan-3-ol

4-(4-fluoropiperidin-1-yl)oxolan-3-ol (PubChem CID 126856877) has the molecular formula C9H16FNO2 and a molecular weight of 189.23 g/mol. Its IUPAC name is 4-(4-fluoropiperidin-1-yl)oxolan-3-ol.

Molecular Properties

Compound Name4-(4-fluoropiperidin-1-yl)oxolan-3-ol
PubChem CID126856877
Molecular FormulaC9H16FNO2
Molecular Weight189.23 g/mol
Exact Mass189.12
IUPAC Name4-(4-fluoropiperidin-1-yl)oxolan-3-ol
SMILESOC1COCC1N1CCC(F)CC1
InChIInChI=1S/C9H16FNO2/c10-7-1-3-11(4-2-7)8-5-13-6-9(8)12/h7-9,12H,1-6H2
InChIKeyPVDSXAZDIROSSE-UHFFFAOYSA-N
XLogP0.18
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.23
LogP ≤ 50.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-(4-fluoropiperidin-1-yl)oxolan-3-ol?
The IUPAC name of 4-(4-fluoropiperidin-1-yl)oxolan-3-ol (CID 126856877) is 4-(4-fluoropiperidin-1-yl)oxolan-3-ol.
What is the SMILES notation for 4-(4-fluoropiperidin-1-yl)oxolan-3-ol?
The canonical SMILES for 4-(4-fluoropiperidin-1-yl)oxolan-3-ol is OC1COCC1N1CCC(F)CC1.
What is the InChIKey of 4-(4-fluoropiperidin-1-yl)oxolan-3-ol?
The InChIKey is PVDSXAZDIROSSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16FNO2/c10-7-1-3-11(4-2-7)8-5-13-6-9(8)12/h7-9,12H,1-6H2.
What are the key properties of 4-(4-fluoropiperidin-1-yl)oxolan-3-ol?
4-(4-fluoropiperidin-1-yl)oxolan-3-ol has a molecular weight of 189.23 g/mol, XLogP of 0.18, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-fluoropiperidin-1-yl)oxolan-3-ol is sourced from PubChem (CID 126856877), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).