5-(4-fluorophenyl)-N-piperidin-1-ylpyridine-3-carboxamide

C17H18FN3O — CID 69064540

IUPAC5-(4-fluorophenyl)-N-piperidin-1-ylpyridine-3-carboxamide
SMILESO=C(NN1CCCCC1)c1cncc(-c2ccc(F)cc2)c1
InChIInChI=1S/C17H18FN3O/c18-16-6-4-13(5-7-16)14-10-15(12-19-11-14)17(22)20-21-8-2-1-3-9-21/h4-7,10-12H,1-3,8-9H2,(H,20,22)
InChIKeyLOILTWINOHNXLT-UHFFFAOYSA-N
MW299.35 g/mol
LogP3.02
Rot. Bonds3

About 5-(4-fluorophenyl)-N-piperidin-1-ylpyridine-3-carboxamide

5-(4-fluorophenyl)-N-piperidin-1-ylpyridine-3-carboxamide (PubChem CID 69064540) has the molecular formula C17H18FN3O and a molecular weight of 299.35 g/mol. Its IUPAC name is 5-(4-fluorophenyl)-N-piperidin-1-ylpyridine-3-carboxamide.

Molecular Properties

Compound Name5-(4-fluorophenyl)-N-piperidin-1-ylpyridine-3-carboxamide
PubChem CID69064540
Molecular FormulaC17H18FN3O
Molecular Weight299.35 g/mol
Exact Mass299.14
IUPAC Name5-(4-fluorophenyl)-N-piperidin-1-ylpyridine-3-carboxamide
SMILESO=C(NN1CCCCC1)c1cncc(-c2ccc(F)cc2)c1
InChIInChI=1S/C17H18FN3O/c18-16-6-4-13(5-7-16)14-10-15(12-19-11-14)17(22)20-21-8-2-1-3-9-21/h4-7,10-12H,1-3,8-9H2,(H,20,22)
InChIKeyLOILTWINOHNXLT-UHFFFAOYSA-N
XLogP3.02
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.35
LogP ≤ 53.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-(4-fluorophenyl)-N-piperidin-1-ylpyridine-3-carboxamide?
The IUPAC name of 5-(4-fluorophenyl)-N-piperidin-1-ylpyridine-3-carboxamide (CID 69064540) is 5-(4-fluorophenyl)-N-piperidin-1-ylpyridine-3-carboxamide.
What is the SMILES notation for 5-(4-fluorophenyl)-N-piperidin-1-ylpyridine-3-carboxamide?
The canonical SMILES for 5-(4-fluorophenyl)-N-piperidin-1-ylpyridine-3-carboxamide is O=C(NN1CCCCC1)c1cncc(-c2ccc(F)cc2)c1.
What is the InChIKey of 5-(4-fluorophenyl)-N-piperidin-1-ylpyridine-3-carboxamide?
The InChIKey is LOILTWINOHNXLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18FN3O/c18-16-6-4-13(5-7-16)14-10-15(12-19-11-14)17(22)20-21-8-2-1-3-9-21/h4-7,10-12H,1-3,8-9H2,(H,20,22).
What are the key properties of 5-(4-fluorophenyl)-N-piperidin-1-ylpyridine-3-carboxamide?
5-(4-fluorophenyl)-N-piperidin-1-ylpyridine-3-carboxamide has a molecular weight of 299.35 g/mol, XLogP of 3.02, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-fluorophenyl)-N-piperidin-1-ylpyridine-3-carboxamide is sourced from PubChem (CID 69064540), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).