6-[4-(4-cyanophenoxy)phenyl]-4-(N-methylanilino)pyridine-2-carboxamide

C26H20N4O2 — CID 66799597

IUPAC6-[4-(4-cyanophenoxy)phenyl]-4-(N-methylanilino)pyridine-2-carboxamide
SMILESCN(c1ccccc1)c1cc(C(N)=O)nc(-c2ccc(Oc3ccc(C#N)cc3)cc2)c1
InChIInChI=1S/C26H20N4O2/c1-30(20-5-3-2-4-6-20)21-15-24(29-25(16-21)26(28)31)19-9-13-23(14-10-19)32-22-11-7-18(17-27)8-12-22/h2-16H,1H3,(H2,28,31)
InChIKeyYUPPYWRSRQNJKM-UHFFFAOYSA-N
MW420.47 g/mol
LogP5.28
Rot. Bonds6

About 6-[4-(4-cyanophenoxy)phenyl]-4-(N-methylanilino)pyridine-2-carboxamide

6-[4-(4-cyanophenoxy)phenyl]-4-(N-methylanilino)pyridine-2-carboxamide (PubChem CID 66799597) has the molecular formula C26H20N4O2 and a molecular weight of 420.47 g/mol. Its IUPAC name is 6-[4-(4-cyanophenoxy)phenyl]-4-(N-methylanilino)pyridine-2-carboxamide.

Molecular Properties

Compound Name6-[4-(4-cyanophenoxy)phenyl]-4-(N-methylanilino)pyridine-2-carboxamide
PubChem CID66799597
Molecular FormulaC26H20N4O2
Molecular Weight420.47 g/mol
Exact Mass420.16
IUPAC Name6-[4-(4-cyanophenoxy)phenyl]-4-(N-methylanilino)pyridine-2-carboxamide
SMILESCN(c1ccccc1)c1cc(C(N)=O)nc(-c2ccc(Oc3ccc(C#N)cc3)cc2)c1
InChIInChI=1S/C26H20N4O2/c1-30(20-5-3-2-4-6-20)21-15-24(29-25(16-21)26(28)31)19-9-13-23(14-10-19)32-22-11-7-18(17-27)8-12-22/h2-16H,1H3,(H2,28,31)
InChIKeyYUPPYWRSRQNJKM-UHFFFAOYSA-N
XLogP5.28
TPSA92.24 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms32
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500420.47
LogP ≤ 55.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 6-[4-(4-cyanophenoxy)phenyl]-4-(N-methylanilino)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 6-[4-(4-cyanophenoxy)phenyl]-4-(N-methylanilino)pyridine-2-carboxamide?
The IUPAC name of 6-[4-(4-cyanophenoxy)phenyl]-4-(N-methylanilino)pyridine-2-carboxamide (CID 66799597) is 6-[4-(4-cyanophenoxy)phenyl]-4-(N-methylanilino)pyridine-2-carboxamide.
What is the SMILES notation for 6-[4-(4-cyanophenoxy)phenyl]-4-(N-methylanilino)pyridine-2-carboxamide?
The canonical SMILES for 6-[4-(4-cyanophenoxy)phenyl]-4-(N-methylanilino)pyridine-2-carboxamide is CN(c1ccccc1)c1cc(C(N)=O)nc(-c2ccc(Oc3ccc(C#N)cc3)cc2)c1.
What is the InChIKey of 6-[4-(4-cyanophenoxy)phenyl]-4-(N-methylanilino)pyridine-2-carboxamide?
The InChIKey is YUPPYWRSRQNJKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H20N4O2/c1-30(20-5-3-2-4-6-20)21-15-24(29-25(16-21)26(28)31)19-9-13-23(14-10-19)32-22-11-7-18(17-27)8-12-22/h2-16H,1H3,(H2,28,31).
What are the key properties of 6-[4-(4-cyanophenoxy)phenyl]-4-(N-methylanilino)pyridine-2-carboxamide?
6-[4-(4-cyanophenoxy)phenyl]-4-(N-methylanilino)pyridine-2-carboxamide has a molecular weight of 420.47 g/mol, XLogP of 5.28, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[4-(4-cyanophenoxy)phenyl]-4-(N-methylanilino)pyridine-2-carboxamide is sourced from PubChem (CID 66799597), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).