2-N-(4-cyanophenyl)-6-N-ethyl-6-N-(3-methylphenyl)pyridine-2,6-dicarboxamide

C23H20N4O2 — CID 109101116

IUPAC2-N-(4-cyanophenyl)-6-N-ethyl-6-N-(3-methylphenyl)pyridine-2,6-dicarboxamide
SMILESCCN(C(=O)c1cccc(C(=O)Nc2ccc(C#N)cc2)n1)c1cccc(C)c1
InChIInChI=1S/C23H20N4O2/c1-3-27(19-7-4-6-16(2)14-19)23(29)21-9-5-8-20(26-21)22(28)25-18-12-10-17(15-24)11-13-18/h4-14H,3H2,1-2H3,(H,25,28)
InChIKeyLJDOTZCCWATUQW-UHFFFAOYSA-N
MW384.44 g/mol
LogP4.18
Rot. Bonds5

About 2-N-(4-cyanophenyl)-6-N-ethyl-6-N-(3-methylphenyl)pyridine-2,6-dicarboxamide

2-N-(4-cyanophenyl)-6-N-ethyl-6-N-(3-methylphenyl)pyridine-2,6-dicarboxamide (PubChem CID 109101116) has the molecular formula C23H20N4O2 and a molecular weight of 384.44 g/mol. Its IUPAC name is 2-N-(4-cyanophenyl)-6-N-ethyl-6-N-(3-methylphenyl)pyridine-2,6-dicarboxamide.

Molecular Properties

Compound Name2-N-(4-cyanophenyl)-6-N-ethyl-6-N-(3-methylphenyl)pyridine-2,6-dicarboxamide
PubChem CID109101116
Molecular FormulaC23H20N4O2
Molecular Weight384.44 g/mol
Exact Mass384.16
IUPAC Name2-N-(4-cyanophenyl)-6-N-ethyl-6-N-(3-methylphenyl)pyridine-2,6-dicarboxamide
SMILESCCN(C(=O)c1cccc(C(=O)Nc2ccc(C#N)cc2)n1)c1cccc(C)c1
InChIInChI=1S/C23H20N4O2/c1-3-27(19-7-4-6-16(2)14-19)23(29)21-9-5-8-20(26-21)22(28)25-18-12-10-17(15-24)11-13-18/h4-14H,3H2,1-2H3,(H,25,28)
InChIKeyLJDOTZCCWATUQW-UHFFFAOYSA-N
XLogP4.18
TPSA86.09 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500384.44
LogP ≤ 54.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-(4-cyanophenyl)-1-ethyl-1-(3-methylphenyl)urea
CID 108992791
6-N-ethyl-2-N-(4-ethylphenyl)-6-N-phenylpyridine-2,6-dicarboxamide
CID 109100571
3-cyano-N-ethyl-N-(3-methylphenyl)benzamide
CID 60737545
2-N-(4-cyanophenyl)-6-N-(4-methoxyphenyl)pyridine-2,6-dicarboxamide
CID 109100968
6-N-(3-chlorophenyl)-2-N-(4-cyanophenyl)pyridine-2,6-dicarboxamide
CID 109100845
6-amino-N-ethyl-N-(3-methylphenyl)pyridine-2-carboxamide
CID 62239482
6-N-ethyl-2-N-(furan-2-ylmethyl)-6-N-(3-methylphenyl)pyridine-2,6-dicarboxamide
CID 109097206
2-N-(4-cyanophenyl)-6-N-(4-propan-2-ylphenyl)pyridine-2,6-dicarboxamide
CID 109100676
2-N,6-N-bis[4-(diethylamino)phenyl]pyridine-2,6-dicarboxamide
CID 1019302
N-ethyl-2-(3-methylanilino)-N-(3-methylphenyl)pyrimidine-4-carboxamide
CID 109313892
3-N-(3-chlorophenyl)-5-N-ethyl-5-N-(3-methylphenyl)pyridine-3,5-dicarboxamide
CID 109108801
6-N-(3-methylphenyl)-2-N-phenylpyridine-2,6-dicarboxamide
CID 109099953

Frequently Asked Questions

What is the IUPAC name of 2-N-(4-cyanophenyl)-6-N-ethyl-6-N-(3-methylphenyl)pyridine-2,6-dicarboxamide?
The IUPAC name of 2-N-(4-cyanophenyl)-6-N-ethyl-6-N-(3-methylphenyl)pyridine-2,6-dicarboxamide (CID 109101116) is 2-N-(4-cyanophenyl)-6-N-ethyl-6-N-(3-methylphenyl)pyridine-2,6-dicarboxamide.
What is the SMILES notation for 2-N-(4-cyanophenyl)-6-N-ethyl-6-N-(3-methylphenyl)pyridine-2,6-dicarboxamide?
The canonical SMILES for 2-N-(4-cyanophenyl)-6-N-ethyl-6-N-(3-methylphenyl)pyridine-2,6-dicarboxamide is CCN(C(=O)c1cccc(C(=O)Nc2ccc(C#N)cc2)n1)c1cccc(C)c1.
What is the InChIKey of 2-N-(4-cyanophenyl)-6-N-ethyl-6-N-(3-methylphenyl)pyridine-2,6-dicarboxamide?
The InChIKey is LJDOTZCCWATUQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H20N4O2/c1-3-27(19-7-4-6-16(2)14-19)23(29)21-9-5-8-20(26-21)22(28)25-18-12-10-17(15-24)11-13-18/h4-14H,3H2,1-2H3,(H,25,28).
What are the key properties of 2-N-(4-cyanophenyl)-6-N-ethyl-6-N-(3-methylphenyl)pyridine-2,6-dicarboxamide?
2-N-(4-cyanophenyl)-6-N-ethyl-6-N-(3-methylphenyl)pyridine-2,6-dicarboxamide has a molecular weight of 384.44 g/mol, XLogP of 4.18, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-(4-cyanophenyl)-6-N-ethyl-6-N-(3-methylphenyl)pyridine-2,6-dicarboxamide is sourced from PubChem (CID 109101116), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).