4-N-(4-cyanophenyl)-2-N-(2,6-diethylphenyl)pyridine-2,4-dicarboxamide

C24H22N4O2 — CID 109092546

IUPAC4-N-(4-cyanophenyl)-2-N-(2,6-diethylphenyl)pyridine-2,4-dicarboxamide
SMILESCCc1cccc(CC)c1NC(=O)c1cc(C(=O)Nc2ccc(C#N)cc2)ccn1
InChIInChI=1S/C24H22N4O2/c1-3-17-6-5-7-18(4-2)22(17)28-24(30)21-14-19(12-13-26-21)23(29)27-20-10-8-16(15-25)9-11-20/h5-14H,3-4H2,1-2H3,(H,27,29)(H,28,30)
InChIKeyVLTWDARMWLRBIH-UHFFFAOYSA-N
MW398.47 g/mol
LogP4.58
Rot. Bonds6

About 4-N-(4-cyanophenyl)-2-N-(2,6-diethylphenyl)pyridine-2,4-dicarboxamide

4-N-(4-cyanophenyl)-2-N-(2,6-diethylphenyl)pyridine-2,4-dicarboxamide (PubChem CID 109092546) has the molecular formula C24H22N4O2 and a molecular weight of 398.47 g/mol. Its IUPAC name is 4-N-(4-cyanophenyl)-2-N-(2,6-diethylphenyl)pyridine-2,4-dicarboxamide.

Molecular Properties

Compound Name4-N-(4-cyanophenyl)-2-N-(2,6-diethylphenyl)pyridine-2,4-dicarboxamide
PubChem CID109092546
Molecular FormulaC24H22N4O2
Molecular Weight398.47 g/mol
Exact Mass398.17
IUPAC Name4-N-(4-cyanophenyl)-2-N-(2,6-diethylphenyl)pyridine-2,4-dicarboxamide
SMILESCCc1cccc(CC)c1NC(=O)c1cc(C(=O)Nc2ccc(C#N)cc2)ccn1
InChIInChI=1S/C24H22N4O2/c1-3-17-6-5-7-18(4-2)22(17)28-24(30)21-14-19(12-13-26-21)23(29)27-20-10-8-16(15-25)9-11-20/h5-14H,3-4H2,1-2H3,(H,27,29)(H,28,30)
InChIKeyVLTWDARMWLRBIH-UHFFFAOYSA-N
XLogP4.58
TPSA94.88 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500398.47
LogP ≤ 54.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-N-(4-cyanophenyl)-4-N-(3-methoxyphenyl)pyridine-2,4-dicarboxamide
CID 109093044
4-N-(4-acetamidophenyl)-2-N-(3-cyanophenyl)pyridine-2,4-dicarboxamide
CID 109093227
4-N-tert-butyl-2-N-(4-cyanophenyl)pyridine-2,4-dicarboxamide
CID 109089232
4-cyano-N-(2,6-diethylphenyl)benzamide
CID 2592061
4-N-(2-cyanophenyl)-2-N-(2-ethyl-6-methylphenyl)pyridine-2,4-dicarboxamide
CID 109092426
2-N-(4-chloro-2-methylphenyl)-4-N-(4-cyanophenyl)pyridine-2,4-dicarboxamide
CID 109092943
4-N-(3-cyanophenyl)-2-N-[4-(dimethylamino)phenyl]pyridine-2,4-dicarboxamide
CID 109093258
4-N-(4-chloro-2-methylphenyl)-2-N-(4-cyanophenyl)pyridine-2,4-dicarboxamide
CID 109092935
4-N-(4-cyanophenyl)-2-N-(pyridin-4-ylmethyl)pyridine-2,4-dicarboxamide
CID 109087689
2-N-(2-ethylphenyl)-4-N-phenylpyridine-2,4-dicarboxamide
CID 109090820
4-N-cyclopentyl-2-N-(2,6-diethylphenyl)pyridine-2,4-dicarboxamide
CID 109080782
4-N-(4-cyanophenyl)-2-N-cyclopentylpyridine-2,4-dicarboxamide
CID 109081016

Frequently Asked Questions

What is the IUPAC name of 4-N-(4-cyanophenyl)-2-N-(2,6-diethylphenyl)pyridine-2,4-dicarboxamide?
The IUPAC name of 4-N-(4-cyanophenyl)-2-N-(2,6-diethylphenyl)pyridine-2,4-dicarboxamide (CID 109092546) is 4-N-(4-cyanophenyl)-2-N-(2,6-diethylphenyl)pyridine-2,4-dicarboxamide.
What is the SMILES notation for 4-N-(4-cyanophenyl)-2-N-(2,6-diethylphenyl)pyridine-2,4-dicarboxamide?
The canonical SMILES for 4-N-(4-cyanophenyl)-2-N-(2,6-diethylphenyl)pyridine-2,4-dicarboxamide is CCc1cccc(CC)c1NC(=O)c1cc(C(=O)Nc2ccc(C#N)cc2)ccn1.
What is the InChIKey of 4-N-(4-cyanophenyl)-2-N-(2,6-diethylphenyl)pyridine-2,4-dicarboxamide?
The InChIKey is VLTWDARMWLRBIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H22N4O2/c1-3-17-6-5-7-18(4-2)22(17)28-24(30)21-14-19(12-13-26-21)23(29)27-20-10-8-16(15-25)9-11-20/h5-14H,3-4H2,1-2H3,(H,27,29)(H,28,30).
What are the key properties of 4-N-(4-cyanophenyl)-2-N-(2,6-diethylphenyl)pyridine-2,4-dicarboxamide?
4-N-(4-cyanophenyl)-2-N-(2,6-diethylphenyl)pyridine-2,4-dicarboxamide has a molecular weight of 398.47 g/mol, XLogP of 4.58, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N-(4-cyanophenyl)-2-N-(2,6-diethylphenyl)pyridine-2,4-dicarboxamide is sourced from PubChem (CID 109092546), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).