4-fluoro-N-[6-(1-methylpiperidin-4-yl)oxy-2-pyridinyl]benzamide

C18H20FN3O2 — CID 10381909

IUPAC4-fluoro-N-[6-(1-methylpiperidin-4-yl)oxy-2-pyridinyl]benzamide
SMILESCN1CCC(Oc2cccc(NC(=O)c3ccc(F)cc3)n2)CC1
InChIInChI=1S/C18H20FN3O2/c1-22-11-9-15(10-12-22)24-17-4-2-3-16(20-17)21-18(23)13-5-7-14(19)8-6-13/h2-8,15H,9-12H2,1H3,(H,20,21,23)
InChIKeyHXGZAUMDOPLWBX-UHFFFAOYSA-N
MW329.38 g/mol
LogP2.95
Rot. Bonds4

About 4-fluoro-N-[6-(1-methylpiperidin-4-yl)oxy-2-pyridinyl]benzamide

4-fluoro-N-[6-(1-methylpiperidin-4-yl)oxy-2-pyridinyl]benzamide (PubChem CID 10381909) has the molecular formula C18H20FN3O2 and a molecular weight of 329.38 g/mol. Its IUPAC name is 4-fluoro-N-[6-(1-methylpiperidin-4-yl)oxy-2-pyridinyl]benzamide.

Molecular Properties

Compound Name4-fluoro-N-[6-(1-methylpiperidin-4-yl)oxy-2-pyridinyl]benzamide
PubChem CID10381909
Molecular FormulaC18H20FN3O2
Molecular Weight329.38 g/mol
Exact Mass329.15
IUPAC Name4-fluoro-N-[6-(1-methylpiperidin-4-yl)oxy-2-pyridinyl]benzamide
SMILESCN1CCC(Oc2cccc(NC(=O)c3ccc(F)cc3)n2)CC1
InChIInChI=1S/C18H20FN3O2/c1-22-11-9-15(10-12-22)24-17-4-2-3-16(20-17)21-18(23)13-5-7-14(19)8-6-13/h2-8,15H,9-12H2,1H3,(H,20,21,23)
InChIKeyHXGZAUMDOPLWBX-UHFFFAOYSA-N
XLogP2.95
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.38
LogP ≤ 52.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-fluoro-N-[6-(1-methylpiperidin-4-yl)oxy-2-pyridinyl]benzamide?
The IUPAC name of 4-fluoro-N-[6-(1-methylpiperidin-4-yl)oxy-2-pyridinyl]benzamide (CID 10381909) is 4-fluoro-N-[6-(1-methylpiperidin-4-yl)oxy-2-pyridinyl]benzamide.
What is the SMILES notation for 4-fluoro-N-[6-(1-methylpiperidin-4-yl)oxy-2-pyridinyl]benzamide?
The canonical SMILES for 4-fluoro-N-[6-(1-methylpiperidin-4-yl)oxy-2-pyridinyl]benzamide is CN1CCC(Oc2cccc(NC(=O)c3ccc(F)cc3)n2)CC1.
What is the InChIKey of 4-fluoro-N-[6-(1-methylpiperidin-4-yl)oxy-2-pyridinyl]benzamide?
The InChIKey is HXGZAUMDOPLWBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20FN3O2/c1-22-11-9-15(10-12-22)24-17-4-2-3-16(20-17)21-18(23)13-5-7-14(19)8-6-13/h2-8,15H,9-12H2,1H3,(H,20,21,23).
What are the key properties of 4-fluoro-N-[6-(1-methylpiperidin-4-yl)oxy-2-pyridinyl]benzamide?
4-fluoro-N-[6-(1-methylpiperidin-4-yl)oxy-2-pyridinyl]benzamide has a molecular weight of 329.38 g/mol, XLogP of 2.95, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-N-[6-(1-methylpiperidin-4-yl)oxy-2-pyridinyl]benzamide is sourced from PubChem (CID 10381909), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).