2-[1-(4-fluorophenyl)piperidin-4-yl]-N-(5-hydroxy-2-pyridinyl)acetamide

C18H20FN3O2 — CID 135126410

IUPAC2-[1-(4-fluorophenyl)piperidin-4-yl]-N-(5-hydroxy-2-pyridinyl)acetamide
SMILESO=C(CC1CCN(c2ccc(F)cc2)CC1)Nc1ccc(O)cn1
InChIInChI=1S/C18H20FN3O2/c19-14-1-3-15(4-2-14)22-9-7-13(8-10-22)11-18(24)21-17-6-5-16(23)12-20-17/h1-6,12-13,23H,7-11H2,(H,20,21,24)
InChIKeyCSIMWUSDCINVMA-UHFFFAOYSA-N
MW329.38 g/mol
LogP3.17
Rot. Bonds4

About 2-[1-(4-fluorophenyl)piperidin-4-yl]-N-(5-hydroxy-2-pyridinyl)acetamide

2-[1-(4-fluorophenyl)piperidin-4-yl]-N-(5-hydroxy-2-pyridinyl)acetamide (PubChem CID 135126410) has the molecular formula C18H20FN3O2 and a molecular weight of 329.38 g/mol. Its IUPAC name is 2-[1-(4-fluorophenyl)piperidin-4-yl]-N-(5-hydroxy-2-pyridinyl)acetamide.

Molecular Properties

Compound Name2-[1-(4-fluorophenyl)piperidin-4-yl]-N-(5-hydroxy-2-pyridinyl)acetamide
PubChem CID135126410
Molecular FormulaC18H20FN3O2
Molecular Weight329.38 g/mol
Exact Mass329.15
IUPAC Name2-[1-(4-fluorophenyl)piperidin-4-yl]-N-(5-hydroxy-2-pyridinyl)acetamide
SMILESO=C(CC1CCN(c2ccc(F)cc2)CC1)Nc1ccc(O)cn1
InChIInChI=1S/C18H20FN3O2/c19-14-1-3-15(4-2-14)22-9-7-13(8-10-22)11-18(24)21-17-6-5-16(23)12-20-17/h1-6,12-13,23H,7-11H2,(H,20,21,24)
InChIKeyCSIMWUSDCINVMA-UHFFFAOYSA-N
XLogP3.17
TPSA65.46 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.38
LogP ≤ 53.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[1-(4-fluorophenyl)piperidin-4-yl]-N-(5-hydroxy-2-pyridinyl)acetamide?
The IUPAC name of 2-[1-(4-fluorophenyl)piperidin-4-yl]-N-(5-hydroxy-2-pyridinyl)acetamide (CID 135126410) is 2-[1-(4-fluorophenyl)piperidin-4-yl]-N-(5-hydroxy-2-pyridinyl)acetamide.
What is the SMILES notation for 2-[1-(4-fluorophenyl)piperidin-4-yl]-N-(5-hydroxy-2-pyridinyl)acetamide?
The canonical SMILES for 2-[1-(4-fluorophenyl)piperidin-4-yl]-N-(5-hydroxy-2-pyridinyl)acetamide is O=C(CC1CCN(c2ccc(F)cc2)CC1)Nc1ccc(O)cn1.
What is the InChIKey of 2-[1-(4-fluorophenyl)piperidin-4-yl]-N-(5-hydroxy-2-pyridinyl)acetamide?
The InChIKey is CSIMWUSDCINVMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20FN3O2/c19-14-1-3-15(4-2-14)22-9-7-13(8-10-22)11-18(24)21-17-6-5-16(23)12-20-17/h1-6,12-13,23H,7-11H2,(H,20,21,24).
What are the key properties of 2-[1-(4-fluorophenyl)piperidin-4-yl]-N-(5-hydroxy-2-pyridinyl)acetamide?
2-[1-(4-fluorophenyl)piperidin-4-yl]-N-(5-hydroxy-2-pyridinyl)acetamide has a molecular weight of 329.38 g/mol, XLogP of 3.17, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(4-fluorophenyl)piperidin-4-yl]-N-(5-hydroxy-2-pyridinyl)acetamide is sourced from PubChem (CID 135126410), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).