2-N-(2-cyanophenyl)-4-N-(pyridin-2-ylmethyl)pyridine-2,4-dicarboxamide

C20H15N5O2 — CID 109087198

IUPAC2-N-(2-cyanophenyl)-4-N-(pyridin-2-ylmethyl)pyridine-2,4-dicarboxamide
SMILESN#Cc1ccccc1NC(=O)c1cc(C(=O)NCc2ccccn2)ccn1
InChIInChI=1S/C20H15N5O2/c21-12-15-5-1-2-7-17(15)25-20(27)18-11-14(8-10-23-18)19(26)24-13-16-6-3-4-9-22-16/h1-11H,13H2,(H,24,26)(H,25,27)
InChIKeySDVAZIINUPVUNK-UHFFFAOYSA-N
MW357.37 g/mol
LogP2.53
Rot. Bonds5

About 2-N-(2-cyanophenyl)-4-N-(pyridin-2-ylmethyl)pyridine-2,4-dicarboxamide

2-N-(2-cyanophenyl)-4-N-(pyridin-2-ylmethyl)pyridine-2,4-dicarboxamide (PubChem CID 109087198) has the molecular formula C20H15N5O2 and a molecular weight of 357.37 g/mol. Its IUPAC name is 2-N-(2-cyanophenyl)-4-N-(pyridin-2-ylmethyl)pyridine-2,4-dicarboxamide.

Molecular Properties

Compound Name2-N-(2-cyanophenyl)-4-N-(pyridin-2-ylmethyl)pyridine-2,4-dicarboxamide
PubChem CID109087198
Molecular FormulaC20H15N5O2
Molecular Weight357.37 g/mol
Exact Mass357.12
IUPAC Name2-N-(2-cyanophenyl)-4-N-(pyridin-2-ylmethyl)pyridine-2,4-dicarboxamide
SMILESN#Cc1ccccc1NC(=O)c1cc(C(=O)NCc2ccccn2)ccn1
InChIInChI=1S/C20H15N5O2/c21-12-15-5-1-2-7-17(15)25-20(27)18-11-14(8-10-23-18)19(26)24-13-16-6-3-4-9-22-16/h1-11H,13H2,(H,24,26)(H,25,27)
InChIKeySDVAZIINUPVUNK-UHFFFAOYSA-N
XLogP2.53
TPSA107.77 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.37
LogP ≤ 52.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-N-(2-cyanophenyl)-4-N-[(2-methylphenyl)methyl]pyridine-2,4-dicarboxamide
CID 109085583
2-N-[(4-chlorophenyl)methyl]-4-N-(2-cyanophenyl)pyridine-2,4-dicarboxamide
CID 109086782
4-N-butyl-2-N-(2-cyanophenyl)pyridine-2,4-dicarboxamide
CID 109079363
4-N-(pyridin-2-ylmethyl)-2-N-(2,3,4-trifluorophenyl)pyridine-2,4-dicarboxamide
CID 109087202
2-N-(2-cyanophenyl)-4-N-(3-methoxypropyl)pyridine-2,4-dicarboxamide
CID 109082631
2-N-(2-cyanophenyl)-4-N-(2-methylphenyl)pyridine-2,4-dicarboxamide
CID 109091043
2-N-butyl-4-N-(2-cyanophenyl)pyridine-2,4-dicarboxamide
CID 109079552
5-(2-cyanoanilino)-N-(pyridin-2-ylmethyl)pyridine-3-carboxamide
CID 109235050
2-N-(5-methyl-1,2-oxazol-3-yl)-4-N-(pyridin-2-ylmethyl)pyridine-2,4-dicarboxamide
CID 109087205
4-N-(2-cyanophenyl)-2-N-(2,3,4-trifluorophenyl)pyridine-2,4-dicarboxamide
CID 109093370
4-(2-cyanoanilino)-N-(2-cyanophenyl)pyridine-2-carboxamide
CID 109222697
2-N-(4-tert-butylphenyl)-4-N-(2-cyanophenyl)pyridine-2,4-dicarboxamide
CID 109092586

Frequently Asked Questions

What is the IUPAC name of 2-N-(2-cyanophenyl)-4-N-(pyridin-2-ylmethyl)pyridine-2,4-dicarboxamide?
The IUPAC name of 2-N-(2-cyanophenyl)-4-N-(pyridin-2-ylmethyl)pyridine-2,4-dicarboxamide (CID 109087198) is 2-N-(2-cyanophenyl)-4-N-(pyridin-2-ylmethyl)pyridine-2,4-dicarboxamide.
What is the SMILES notation for 2-N-(2-cyanophenyl)-4-N-(pyridin-2-ylmethyl)pyridine-2,4-dicarboxamide?
The canonical SMILES for 2-N-(2-cyanophenyl)-4-N-(pyridin-2-ylmethyl)pyridine-2,4-dicarboxamide is N#Cc1ccccc1NC(=O)c1cc(C(=O)NCc2ccccn2)ccn1.
What is the InChIKey of 2-N-(2-cyanophenyl)-4-N-(pyridin-2-ylmethyl)pyridine-2,4-dicarboxamide?
The InChIKey is SDVAZIINUPVUNK-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H15N5O2/c21-12-15-5-1-2-7-17(15)25-20(27)18-11-14(8-10-23-18)19(26)24-13-16-6-3-4-9-22-16/h1-11H,13H2,(H,24,26)(H,25,27).
What are the key properties of 2-N-(2-cyanophenyl)-4-N-(pyridin-2-ylmethyl)pyridine-2,4-dicarboxamide?
2-N-(2-cyanophenyl)-4-N-(pyridin-2-ylmethyl)pyridine-2,4-dicarboxamide has a molecular weight of 357.37 g/mol, XLogP of 2.53, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-(2-cyanophenyl)-4-N-(pyridin-2-ylmethyl)pyridine-2,4-dicarboxamide is sourced from PubChem (CID 109087198), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).