2-N-(3-cyanophenyl)-6-N-(2-methyl-6-propan-2-ylphenyl)pyridine-2,6-dicarboxamide

C24H22N4O2 — CID 109100701

IUPAC2-N-(3-cyanophenyl)-6-N-(2-methyl-6-propan-2-ylphenyl)pyridine-2,6-dicarboxamide
SMILESCc1cccc(C(C)C)c1NC(=O)c1cccc(C(=O)Nc2cccc(C#N)c2)n1
InChIInChI=1S/C24H22N4O2/c1-15(2)19-10-4-7-16(3)22(19)28-24(30)21-12-6-11-20(27-21)23(29)26-18-9-5-8-17(13-18)14-25/h4-13,15H,1-3H3,(H,26,29)(H,28,30)
InChIKeyDVJCEIBWHKRBPX-UHFFFAOYSA-N
MW398.47 g/mol
LogP4.89
Rot. Bonds5

About 2-N-(3-cyanophenyl)-6-N-(2-methyl-6-propan-2-ylphenyl)pyridine-2,6-dicarboxamide

2-N-(3-cyanophenyl)-6-N-(2-methyl-6-propan-2-ylphenyl)pyridine-2,6-dicarboxamide (PubChem CID 109100701) has the molecular formula C24H22N4O2 and a molecular weight of 398.47 g/mol. Its IUPAC name is 2-N-(3-cyanophenyl)-6-N-(2-methyl-6-propan-2-ylphenyl)pyridine-2,6-dicarboxamide.

Molecular Properties

Compound Name2-N-(3-cyanophenyl)-6-N-(2-methyl-6-propan-2-ylphenyl)pyridine-2,6-dicarboxamide
PubChem CID109100701
Molecular FormulaC24H22N4O2
Molecular Weight398.47 g/mol
Exact Mass398.17
IUPAC Name2-N-(3-cyanophenyl)-6-N-(2-methyl-6-propan-2-ylphenyl)pyridine-2,6-dicarboxamide
SMILESCc1cccc(C(C)C)c1NC(=O)c1cccc(C(=O)Nc2cccc(C#N)c2)n1
InChIInChI=1S/C24H22N4O2/c1-15(2)19-10-4-7-16(3)22(19)28-24(30)21-12-6-11-20(27-21)23(29)26-18-9-5-8-17(13-18)14-25/h4-13,15H,1-3H3,(H,26,29)(H,28,30)
InChIKeyDVJCEIBWHKRBPX-UHFFFAOYSA-N
XLogP4.89
TPSA94.88 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500398.47
LogP ≤ 54.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3-cyanophenyl)-2-[2,6-di(propan-2-yl)anilino]pyrimidine-4-carboxamide
CID 109318587
2-N-(3-cyanophenyl)-6-N-(2,6-difluorophenyl)pyridine-2,6-dicarboxamide
CID 109101113
6-N-(3-cyanophenyl)-2-N-(2-methylpropyl)pyridine-2,6-dicarboxamide
CID 109094562
6-N-(3-chlorophenyl)-2-N-(3-cyanophenyl)pyridine-2,6-dicarboxamide
CID 109100844
6-fluoro-N-(2-methyl-6-propan-2-ylphenyl)pyridine-2-carboxamide
CID 115496693
2-N-(4-cyanophenyl)-6-N-(4-propan-2-ylphenyl)pyridine-2,6-dicarboxamide
CID 109100676
5-(3-cyanoanilino)-N-(2,6-dimethylphenyl)pyridine-2-carboxamide
CID 109198246
N-(3-cyanophenyl)-2-methyl-6-(2-methylanilino)pyrimidine-4-carboxamide
CID 112848112
N-(3-cyanophenyl)-6-(2-propan-2-ylanilino)pyridazine-3-carboxamide
CID 109128178
6-(2-cyanoanilino)-2-methyl-N-(2-methyl-6-propan-2-ylphenyl)pyrimidine-4-carboxamide
CID 112849713
6-N-(3-chlorophenyl)-2-N-(4-cyanophenyl)pyridine-2,6-dicarboxamide
CID 109100845
N-(4-cyanophenyl)-N'-(2-methyl-6-propan-2-ylphenyl)propanediamide
CID 108954616

Frequently Asked Questions

What is the IUPAC name of 2-N-(3-cyanophenyl)-6-N-(2-methyl-6-propan-2-ylphenyl)pyridine-2,6-dicarboxamide?
The IUPAC name of 2-N-(3-cyanophenyl)-6-N-(2-methyl-6-propan-2-ylphenyl)pyridine-2,6-dicarboxamide (CID 109100701) is 2-N-(3-cyanophenyl)-6-N-(2-methyl-6-propan-2-ylphenyl)pyridine-2,6-dicarboxamide.
What is the SMILES notation for 2-N-(3-cyanophenyl)-6-N-(2-methyl-6-propan-2-ylphenyl)pyridine-2,6-dicarboxamide?
The canonical SMILES for 2-N-(3-cyanophenyl)-6-N-(2-methyl-6-propan-2-ylphenyl)pyridine-2,6-dicarboxamide is Cc1cccc(C(C)C)c1NC(=O)c1cccc(C(=O)Nc2cccc(C#N)c2)n1.
What is the InChIKey of 2-N-(3-cyanophenyl)-6-N-(2-methyl-6-propan-2-ylphenyl)pyridine-2,6-dicarboxamide?
The InChIKey is DVJCEIBWHKRBPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H22N4O2/c1-15(2)19-10-4-7-16(3)22(19)28-24(30)21-12-6-11-20(27-21)23(29)26-18-9-5-8-17(13-18)14-25/h4-13,15H,1-3H3,(H,26,29)(H,28,30).
What are the key properties of 2-N-(3-cyanophenyl)-6-N-(2-methyl-6-propan-2-ylphenyl)pyridine-2,6-dicarboxamide?
2-N-(3-cyanophenyl)-6-N-(2-methyl-6-propan-2-ylphenyl)pyridine-2,6-dicarboxamide has a molecular weight of 398.47 g/mol, XLogP of 4.89, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-(3-cyanophenyl)-6-N-(2-methyl-6-propan-2-ylphenyl)pyridine-2,6-dicarboxamide is sourced from PubChem (CID 109100701), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).