5-(4-fluorophenyl)-N-[2-(2-fluorophenyl)ethyl]pyridine-2-carboxamide

C20H16F2N2O — CID 155564806

IUPAC5-(4-fluorophenyl)-N-[2-(2-fluorophenyl)ethyl]pyridine-2-carboxamide
SMILESO=C(NCCc1ccccc1F)c1ccc(-c2ccc(F)cc2)cn1
InChIInChI=1S/C20H16F2N2O/c21-17-8-5-14(6-9-17)16-7-10-19(24-13-16)20(25)23-12-11-15-3-1-2-4-18(15)22/h1-10,13H,11-12H2,(H,23,25)
InChIKeyXGUPKFJDMVEIKY-UHFFFAOYSA-N
MW338.36 g/mol
LogP4.00
Rot. Bonds5

About 5-(4-fluorophenyl)-N-[2-(2-fluorophenyl)ethyl]pyridine-2-carboxamide

5-(4-fluorophenyl)-N-[2-(2-fluorophenyl)ethyl]pyridine-2-carboxamide (PubChem CID 155564806) has the molecular formula C20H16F2N2O and a molecular weight of 338.36 g/mol. Its IUPAC name is 5-(4-fluorophenyl)-N-[2-(2-fluorophenyl)ethyl]pyridine-2-carboxamide.

Molecular Properties

Compound Name5-(4-fluorophenyl)-N-[2-(2-fluorophenyl)ethyl]pyridine-2-carboxamide
PubChem CID155564806
Molecular FormulaC20H16F2N2O
Molecular Weight338.36 g/mol
Exact Mass338.12
IUPAC Name5-(4-fluorophenyl)-N-[2-(2-fluorophenyl)ethyl]pyridine-2-carboxamide
SMILESO=C(NCCc1ccccc1F)c1ccc(-c2ccc(F)cc2)cn1
InChIInChI=1S/C20H16F2N2O/c21-17-8-5-14(6-9-17)16-7-10-19(24-13-16)20(25)23-12-11-15-3-1-2-4-18(15)22/h1-10,13H,11-12H2,(H,23,25)
InChIKeyXGUPKFJDMVEIKY-UHFFFAOYSA-N
XLogP4.00
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.36
LogP ≤ 54.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-(4-fluorophenyl)-N-[2-(2-fluorophenyl)ethyl]pyridine-2-carboxamide?
The IUPAC name of 5-(4-fluorophenyl)-N-[2-(2-fluorophenyl)ethyl]pyridine-2-carboxamide (CID 155564806) is 5-(4-fluorophenyl)-N-[2-(2-fluorophenyl)ethyl]pyridine-2-carboxamide.
What is the SMILES notation for 5-(4-fluorophenyl)-N-[2-(2-fluorophenyl)ethyl]pyridine-2-carboxamide?
The canonical SMILES for 5-(4-fluorophenyl)-N-[2-(2-fluorophenyl)ethyl]pyridine-2-carboxamide is O=C(NCCc1ccccc1F)c1ccc(-c2ccc(F)cc2)cn1.
What is the InChIKey of 5-(4-fluorophenyl)-N-[2-(2-fluorophenyl)ethyl]pyridine-2-carboxamide?
The InChIKey is XGUPKFJDMVEIKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16F2N2O/c21-17-8-5-14(6-9-17)16-7-10-19(24-13-16)20(25)23-12-11-15-3-1-2-4-18(15)22/h1-10,13H,11-12H2,(H,23,25).
What are the key properties of 5-(4-fluorophenyl)-N-[2-(2-fluorophenyl)ethyl]pyridine-2-carboxamide?
5-(4-fluorophenyl)-N-[2-(2-fluorophenyl)ethyl]pyridine-2-carboxamide has a molecular weight of 338.36 g/mol, XLogP of 4.00, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-fluorophenyl)-N-[2-(2-fluorophenyl)ethyl]pyridine-2-carboxamide is sourced from PubChem (CID 155564806), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).