6-[4-(4-fluorophenoxy)phenyl]-4-(2-morpholin-4-ylethylamino)pyridine-2-carboxamide

C24H25FN4O3 — CID 56943490

IUPAC6-[4-(4-fluorophenoxy)phenyl]-4-(2-morpholin-4-ylethylamino)pyridine-2-carboxamide
SMILESNC(=O)c1cc(NCCN2CCOCC2)cc(-c2ccc(Oc3ccc(F)cc3)cc2)n1
InChIInChI=1S/C24H25FN4O3/c25-18-3-7-21(8-4-18)32-20-5-1-17(2-6-20)22-15-19(16-23(28-22)24(26)30)27-9-10-29-11-13-31-14-12-29/h1-8,15-16H,9-14H2,(H2,26,30)(H,27,28)
InChIKeyAXZRCVZJGPXIAA-UHFFFAOYSA-N
MW436.49 g/mol
LogP3.52
Rot. Bonds8

About 6-[4-(4-fluorophenoxy)phenyl]-4-(2-morpholin-4-ylethylamino)pyridine-2-carboxamide

6-[4-(4-fluorophenoxy)phenyl]-4-(2-morpholin-4-ylethylamino)pyridine-2-carboxamide (PubChem CID 56943490) has the molecular formula C24H25FN4O3 and a molecular weight of 436.49 g/mol. Its IUPAC name is 6-[4-(4-fluorophenoxy)phenyl]-4-(2-morpholin-4-ylethylamino)pyridine-2-carboxamide.

Molecular Properties

Compound Name6-[4-(4-fluorophenoxy)phenyl]-4-(2-morpholin-4-ylethylamino)pyridine-2-carboxamide
PubChem CID56943490
Molecular FormulaC24H25FN4O3
Molecular Weight436.49 g/mol
Exact Mass436.19
IUPAC Name6-[4-(4-fluorophenoxy)phenyl]-4-(2-morpholin-4-ylethylamino)pyridine-2-carboxamide
SMILESNC(=O)c1cc(NCCN2CCOCC2)cc(-c2ccc(Oc3ccc(F)cc3)cc2)n1
InChIInChI=1S/C24H25FN4O3/c25-18-3-7-21(8-4-18)32-20-5-1-17(2-6-20)22-15-19(16-23(28-22)24(26)30)27-9-10-29-11-13-31-14-12-29/h1-8,15-16H,9-14H2,(H2,26,30)(H,27,28)
InChIKeyAXZRCVZJGPXIAA-UHFFFAOYSA-N
XLogP3.52
TPSA89.71 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500436.49
LogP ≤ 53.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 6-[4-(4-fluorophenoxy)phenyl]-4-(2-morpholin-4-ylethylamino)pyridine-2-carboxamide?
The IUPAC name of 6-[4-(4-fluorophenoxy)phenyl]-4-(2-morpholin-4-ylethylamino)pyridine-2-carboxamide (CID 56943490) is 6-[4-(4-fluorophenoxy)phenyl]-4-(2-morpholin-4-ylethylamino)pyridine-2-carboxamide.
What is the SMILES notation for 6-[4-(4-fluorophenoxy)phenyl]-4-(2-morpholin-4-ylethylamino)pyridine-2-carboxamide?
The canonical SMILES for 6-[4-(4-fluorophenoxy)phenyl]-4-(2-morpholin-4-ylethylamino)pyridine-2-carboxamide is NC(=O)c1cc(NCCN2CCOCC2)cc(-c2ccc(Oc3ccc(F)cc3)cc2)n1.
What is the InChIKey of 6-[4-(4-fluorophenoxy)phenyl]-4-(2-morpholin-4-ylethylamino)pyridine-2-carboxamide?
The InChIKey is AXZRCVZJGPXIAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H25FN4O3/c25-18-3-7-21(8-4-18)32-20-5-1-17(2-6-20)22-15-19(16-23(28-22)24(26)30)27-9-10-29-11-13-31-14-12-29/h1-8,15-16H,9-14H2,(H2,26,30)(H,27,28).
What are the key properties of 6-[4-(4-fluorophenoxy)phenyl]-4-(2-morpholin-4-ylethylamino)pyridine-2-carboxamide?
6-[4-(4-fluorophenoxy)phenyl]-4-(2-morpholin-4-ylethylamino)pyridine-2-carboxamide has a molecular weight of 436.49 g/mol, XLogP of 3.52, 8 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[4-(4-fluorophenoxy)phenyl]-4-(2-morpholin-4-ylethylamino)pyridine-2-carboxamide is sourced from PubChem (CID 56943490), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).