6-[(3-fluorophenyl)methoxy]-N-(oxan-4-yl)pyridine-3-carboxamide

C18H19FN2O3 — CID 51036713

IUPAC6-[(3-fluorophenyl)methoxy]-N-(oxan-4-yl)pyridine-3-carboxamide
SMILESO=C(NC1CCOCC1)c1ccc(OCc2cccc(F)c2)nc1
InChIInChI=1S/C18H19FN2O3/c19-15-3-1-2-13(10-15)12-24-17-5-4-14(11-20-17)18(22)21-16-6-8-23-9-7-16/h1-5,10-11,16H,6-9,12H2,(H,21,22)
InChIKeyWJOGWSTYOCRSGB-UHFFFAOYSA-N
MW330.36 g/mol
LogP2.71
Rot. Bonds5

About 6-[(3-fluorophenyl)methoxy]-N-(oxan-4-yl)pyridine-3-carboxamide

6-[(3-fluorophenyl)methoxy]-N-(oxan-4-yl)pyridine-3-carboxamide (PubChem CID 51036713) has the molecular formula C18H19FN2O3 and a molecular weight of 330.36 g/mol. Its IUPAC name is 6-[(3-fluorophenyl)methoxy]-N-(oxan-4-yl)pyridine-3-carboxamide.

Molecular Properties

Compound Name6-[(3-fluorophenyl)methoxy]-N-(oxan-4-yl)pyridine-3-carboxamide
PubChem CID51036713
Molecular FormulaC18H19FN2O3
Molecular Weight330.36 g/mol
Exact Mass330.14
IUPAC Name6-[(3-fluorophenyl)methoxy]-N-(oxan-4-yl)pyridine-3-carboxamide
SMILESO=C(NC1CCOCC1)c1ccc(OCc2cccc(F)c2)nc1
InChIInChI=1S/C18H19FN2O3/c19-15-3-1-2-13(10-15)12-24-17-5-4-14(11-20-17)18(22)21-16-6-8-23-9-7-16/h1-5,10-11,16H,6-9,12H2,(H,21,22)
InChIKeyWJOGWSTYOCRSGB-UHFFFAOYSA-N
XLogP2.71
TPSA60.45 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.36
LogP ≤ 52.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-[(3-fluorophenyl)methoxy]-N-(oxan-4-yl)pyridine-3-carboxamide?
The IUPAC name of 6-[(3-fluorophenyl)methoxy]-N-(oxan-4-yl)pyridine-3-carboxamide (CID 51036713) is 6-[(3-fluorophenyl)methoxy]-N-(oxan-4-yl)pyridine-3-carboxamide.
What is the SMILES notation for 6-[(3-fluorophenyl)methoxy]-N-(oxan-4-yl)pyridine-3-carboxamide?
The canonical SMILES for 6-[(3-fluorophenyl)methoxy]-N-(oxan-4-yl)pyridine-3-carboxamide is O=C(NC1CCOCC1)c1ccc(OCc2cccc(F)c2)nc1.
What is the InChIKey of 6-[(3-fluorophenyl)methoxy]-N-(oxan-4-yl)pyridine-3-carboxamide?
The InChIKey is WJOGWSTYOCRSGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19FN2O3/c19-15-3-1-2-13(10-15)12-24-17-5-4-14(11-20-17)18(22)21-16-6-8-23-9-7-16/h1-5,10-11,16H,6-9,12H2,(H,21,22).
What are the key properties of 6-[(3-fluorophenyl)methoxy]-N-(oxan-4-yl)pyridine-3-carboxamide?
6-[(3-fluorophenyl)methoxy]-N-(oxan-4-yl)pyridine-3-carboxamide has a molecular weight of 330.36 g/mol, XLogP of 2.71, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(3-fluorophenyl)methoxy]-N-(oxan-4-yl)pyridine-3-carboxamide is sourced from PubChem (CID 51036713), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).