3-[4-(2-fluoroethoxy)piperidin-1-yl]propan-1-ol

C10H20FNO2 — CID 87337500

IUPAC3-[4-(2-fluoroethoxy)piperidin-1-yl]propan-1-ol
SMILESOCCCN1CCC(OCCF)CC1
InChIInChI=1S/C10H20FNO2/c11-4-9-14-10-2-6-12(7-3-10)5-1-8-13/h10,13H,1-9H2
InChIKeyCNJYNSSASOWQLL-UHFFFAOYSA-N
MW205.27 g/mol
LogP0.82
Rot. Bonds6

About 3-[4-(2-fluoroethoxy)piperidin-1-yl]propan-1-ol

3-[4-(2-fluoroethoxy)piperidin-1-yl]propan-1-ol (PubChem CID 87337500) has the molecular formula C10H20FNO2 and a molecular weight of 205.27 g/mol. Its IUPAC name is 3-[4-(2-fluoroethoxy)piperidin-1-yl]propan-1-ol.

Molecular Properties

Compound Name3-[4-(2-fluoroethoxy)piperidin-1-yl]propan-1-ol
PubChem CID87337500
Molecular FormulaC10H20FNO2
Molecular Weight205.27 g/mol
Exact Mass205.15
IUPAC Name3-[4-(2-fluoroethoxy)piperidin-1-yl]propan-1-ol
SMILESOCCCN1CCC(OCCF)CC1
InChIInChI=1S/C10H20FNO2/c11-4-9-14-10-2-6-12(7-3-10)5-1-8-13/h10,13H,1-9H2
InChIKeyCNJYNSSASOWQLL-UHFFFAOYSA-N
XLogP0.82
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.27
LogP ≤ 50.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-[4-(2-fluoroethoxy)piperidin-1-yl]propan-1-ol?
The IUPAC name of 3-[4-(2-fluoroethoxy)piperidin-1-yl]propan-1-ol (CID 87337500) is 3-[4-(2-fluoroethoxy)piperidin-1-yl]propan-1-ol.
What is the SMILES notation for 3-[4-(2-fluoroethoxy)piperidin-1-yl]propan-1-ol?
The canonical SMILES for 3-[4-(2-fluoroethoxy)piperidin-1-yl]propan-1-ol is OCCCN1CCC(OCCF)CC1.
What is the InChIKey of 3-[4-(2-fluoroethoxy)piperidin-1-yl]propan-1-ol?
The InChIKey is CNJYNSSASOWQLL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20FNO2/c11-4-9-14-10-2-6-12(7-3-10)5-1-8-13/h10,13H,1-9H2.
What are the key properties of 3-[4-(2-fluoroethoxy)piperidin-1-yl]propan-1-ol?
3-[4-(2-fluoroethoxy)piperidin-1-yl]propan-1-ol has a molecular weight of 205.27 g/mol, XLogP of 0.82, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[4-(2-fluoroethoxy)piperidin-1-yl]propan-1-ol is sourced from PubChem (CID 87337500), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).