4-(4-fluorophenyl)-5-(1-pyridin-4-ylethoxy)pyridine-2-carboxamide

C19H16FN3O2 — CID 122539730

IUPAC4-(4-fluorophenyl)-5-(1-pyridin-4-ylethoxy)pyridine-2-carboxamide
SMILESCC(Oc1cnc(C(N)=O)cc1-c1ccc(F)cc1)c1ccncc1
InChIInChI=1S/C19H16FN3O2/c1-12(13-6-8-22-9-7-13)25-18-11-23-17(19(21)24)10-16(18)14-2-4-15(20)5-3-14/h2-12H,1H3,(H2,21,24)
InChIKeyZIEFBUJMPYRYIO-UHFFFAOYSA-N
MW337.35 g/mol
LogP3.52
Rot. Bonds5

About 4-(4-fluorophenyl)-5-(1-pyridin-4-ylethoxy)pyridine-2-carboxamide

4-(4-fluorophenyl)-5-(1-pyridin-4-ylethoxy)pyridine-2-carboxamide (PubChem CID 122539730) has the molecular formula C19H16FN3O2 and a molecular weight of 337.35 g/mol. Its IUPAC name is 4-(4-fluorophenyl)-5-(1-pyridin-4-ylethoxy)pyridine-2-carboxamide.

Molecular Properties

Compound Name4-(4-fluorophenyl)-5-(1-pyridin-4-ylethoxy)pyridine-2-carboxamide
PubChem CID122539730
Molecular FormulaC19H16FN3O2
Molecular Weight337.35 g/mol
Exact Mass337.12
IUPAC Name4-(4-fluorophenyl)-5-(1-pyridin-4-ylethoxy)pyridine-2-carboxamide
SMILESCC(Oc1cnc(C(N)=O)cc1-c1ccc(F)cc1)c1ccncc1
InChIInChI=1S/C19H16FN3O2/c1-12(13-6-8-22-9-7-13)25-18-11-23-17(19(21)24)10-16(18)14-2-4-15(20)5-3-14/h2-12H,1H3,(H2,21,24)
InChIKeyZIEFBUJMPYRYIO-UHFFFAOYSA-N
XLogP3.52
TPSA78.10 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.35
LogP ≤ 53.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 4-(4-fluorophenyl)-5-(1-pyridin-4-ylethoxy)pyridine-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-(4-fluorophenyl)-5-(1-pyridin-4-ylethoxy)pyridine-2-carboxamide?
The IUPAC name of 4-(4-fluorophenyl)-5-(1-pyridin-4-ylethoxy)pyridine-2-carboxamide (CID 122539730) is 4-(4-fluorophenyl)-5-(1-pyridin-4-ylethoxy)pyridine-2-carboxamide.
What is the SMILES notation for 4-(4-fluorophenyl)-5-(1-pyridin-4-ylethoxy)pyridine-2-carboxamide?
The canonical SMILES for 4-(4-fluorophenyl)-5-(1-pyridin-4-ylethoxy)pyridine-2-carboxamide is CC(Oc1cnc(C(N)=O)cc1-c1ccc(F)cc1)c1ccncc1.
What is the InChIKey of 4-(4-fluorophenyl)-5-(1-pyridin-4-ylethoxy)pyridine-2-carboxamide?
The InChIKey is ZIEFBUJMPYRYIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16FN3O2/c1-12(13-6-8-22-9-7-13)25-18-11-23-17(19(21)24)10-16(18)14-2-4-15(20)5-3-14/h2-12H,1H3,(H2,21,24).
What are the key properties of 4-(4-fluorophenyl)-5-(1-pyridin-4-ylethoxy)pyridine-2-carboxamide?
4-(4-fluorophenyl)-5-(1-pyridin-4-ylethoxy)pyridine-2-carboxamide has a molecular weight of 337.35 g/mol, XLogP of 3.52, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-fluorophenyl)-5-(1-pyridin-4-ylethoxy)pyridine-2-carboxamide is sourced from PubChem (CID 122539730), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).