1-(3-aminooxypropyl)-3-fluoropiperidin-4-ol

C8H17FN2O2 — CID 167131708

IUPAC1-(3-aminooxypropyl)-3-fluoropiperidin-4-ol
SMILESNOCCCN1CCC(O)C(F)C1
InChIInChI=1S/C8H17FN2O2/c9-7-6-11(3-1-5-13-10)4-2-8(7)12/h7-8,12H,1-6,10H2
InChIKeyADGYVOZNFJQPER-UHFFFAOYSA-N
MW192.23 g/mol
LogP-0.33
Rot. Bonds4

About 1-(3-aminooxypropyl)-3-fluoropiperidin-4-ol

1-(3-aminooxypropyl)-3-fluoropiperidin-4-ol (PubChem CID 167131708) has the molecular formula C8H17FN2O2 and a molecular weight of 192.23 g/mol. Its IUPAC name is 1-(3-aminooxypropyl)-3-fluoropiperidin-4-ol.

Molecular Properties

Compound Name1-(3-aminooxypropyl)-3-fluoropiperidin-4-ol
PubChem CID167131708
Molecular FormulaC8H17FN2O2
Molecular Weight192.23 g/mol
Exact Mass192.13
IUPAC Name1-(3-aminooxypropyl)-3-fluoropiperidin-4-ol
SMILESNOCCCN1CCC(O)C(F)C1
InChIInChI=1S/C8H17FN2O2/c9-7-6-11(3-1-5-13-10)4-2-8(7)12/h7-8,12H,1-6,10H2
InChIKeyADGYVOZNFJQPER-UHFFFAOYSA-N
XLogP-0.33
TPSA58.72 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.23
LogP ≤ 5-0.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

1-(2-Fluoroethyl)piperidin-4-ol
CID 40566262
3-(4-Fluoropiperidin-1-yl)propan-1-ol
CID 17980535
3-Fluoro-1-(hydroxymethyl)piperidin-4-ol
CID 54286888
3-[4-(1-Fluoroethoxy)piperidin-1-yl]propan-1-ol
CID 67281078
3-[4-(1-Fluoropropan-2-yloxy)piperidin-1-yl]propan-1-ol
CID 67281900
3-[4-(Difluoromethoxy)piperidin-1-yl]propan-1-ol
CID 67282260
1-(2-Fluoro-3-hydroxypropyl)piperidin-4-ol
CID 69452975
1-(3-Fluoropropyl)piperidin-4-ol
CID 81114743
3-[4-(2-Fluoroethoxy)piperidin-1-yl]propan-1-ol
CID 87337500
3-(3-Fluoropiperidin-1-yl)propan-1-ol
CID 89582223
1-(Fluoromethyl)piperidin-4-ol
CID 117980770
3-Fluoro-1-(propan-2-YL)piperidin-4-OL
CID 129990976

Frequently Asked Questions

What is the IUPAC name of 1-(3-aminooxypropyl)-3-fluoropiperidin-4-ol?
The IUPAC name of 1-(3-aminooxypropyl)-3-fluoropiperidin-4-ol (CID 167131708) is 1-(3-aminooxypropyl)-3-fluoropiperidin-4-ol.
What is the SMILES notation for 1-(3-aminooxypropyl)-3-fluoropiperidin-4-ol?
The canonical SMILES for 1-(3-aminooxypropyl)-3-fluoropiperidin-4-ol is NOCCCN1CCC(O)C(F)C1.
What is the InChIKey of 1-(3-aminooxypropyl)-3-fluoropiperidin-4-ol?
The InChIKey is ADGYVOZNFJQPER-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17FN2O2/c9-7-6-11(3-1-5-13-10)4-2-8(7)12/h7-8,12H,1-6,10H2.
What are the key properties of 1-(3-aminooxypropyl)-3-fluoropiperidin-4-ol?
1-(3-aminooxypropyl)-3-fluoropiperidin-4-ol has a molecular weight of 192.23 g/mol, XLogP of -0.33, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-aminooxypropyl)-3-fluoropiperidin-4-ol is sourced from PubChem (CID 167131708), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).