2-N-(3-chlorophenyl)-4-N-(3-cyanophenyl)pyridine-2,4-dicarboxamide

C20H13ClN4O2 — CID 109092850

IUPAC2-N-(3-chlorophenyl)-4-N-(3-cyanophenyl)pyridine-2,4-dicarboxamide
SMILESN#Cc1cccc(NC(=O)c2ccnc(C(=O)Nc3cccc(Cl)c3)c2)c1
InChIInChI=1S/C20H13ClN4O2/c21-15-4-2-6-17(11-15)25-20(27)18-10-14(7-8-23-18)19(26)24-16-5-1-3-13(9-16)12-22/h1-11H,(H,24,26)(H,25,27)
InChIKeyIBVBKJXGCAMHNM-UHFFFAOYSA-N
MW376.80 g/mol
LogP4.11
Rot. Bonds4

About 2-N-(3-chlorophenyl)-4-N-(3-cyanophenyl)pyridine-2,4-dicarboxamide

2-N-(3-chlorophenyl)-4-N-(3-cyanophenyl)pyridine-2,4-dicarboxamide (PubChem CID 109092850) has the molecular formula C20H13ClN4O2 and a molecular weight of 376.80 g/mol. Its IUPAC name is 2-N-(3-chlorophenyl)-4-N-(3-cyanophenyl)pyridine-2,4-dicarboxamide.

Molecular Properties

Compound Name2-N-(3-chlorophenyl)-4-N-(3-cyanophenyl)pyridine-2,4-dicarboxamide
PubChem CID109092850
Molecular FormulaC20H13ClN4O2
Molecular Weight376.80 g/mol
Exact Mass376.07
IUPAC Name2-N-(3-chlorophenyl)-4-N-(3-cyanophenyl)pyridine-2,4-dicarboxamide
SMILESN#Cc1cccc(NC(=O)c2ccnc(C(=O)Nc3cccc(Cl)c3)c2)c1
InChIInChI=1S/C20H13ClN4O2/c21-15-4-2-6-17(11-15)25-20(27)18-10-14(7-8-23-18)19(26)24-16-5-1-3-13(9-16)12-22/h1-11H,(H,24,26)(H,25,27)
InChIKeyIBVBKJXGCAMHNM-UHFFFAOYSA-N
XLogP4.11
TPSA94.88 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.80
LogP ≤ 54.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-N-(4-acetamidophenyl)-2-N-(3-cyanophenyl)pyridine-2,4-dicarboxamide
CID 109093227
2-N-[(4-chlorophenyl)methyl]-4-N-(3-cyanophenyl)pyridine-2,4-dicarboxamide
CID 109086783
1-N-(3-chlorophenyl)-4-N-(3-cyanophenyl)benzene-1,4-dicarboxamide
CID 109049974
2-N-(3-chloro-2-methylphenyl)-4-N-(3-cyanophenyl)pyridine-2,4-dicarboxamide
CID 109092910
6-N-(3-chlorophenyl)-2-N-(3-cyanophenyl)pyridine-2,6-dicarboxamide
CID 109100844
4-N-(3-cyanophenyl)-2-N-[4-(dimethylamino)phenyl]pyridine-2,4-dicarboxamide
CID 109093258
2-N-(3-cyanophenyl)-4-N-propylpyridine-2,4-dicarboxamide
CID 109077804
4-N-(3-cyanophenyl)-2-N-(2,5-dimethylphenyl)pyridine-2,4-dicarboxamide
CID 109091863
4-N-(3-cyanophenyl)-2-N-prop-2-enylpyridine-2,4-dicarboxamide
CID 109079174
2-N-(3-chlorophenyl)-4-N-(3,4-dimethylphenyl)pyridine-2,4-dicarboxamide
CID 109091882
4-N-(3-chlorophenyl)-2-N-(3-methoxyphenyl)pyridine-2,4-dicarboxamide
CID 109092816
N-(3-cyanophenyl)pyridine-4-carboxamide
CID 734714

Frequently Asked Questions

What is the IUPAC name of 2-N-(3-chlorophenyl)-4-N-(3-cyanophenyl)pyridine-2,4-dicarboxamide?
The IUPAC name of 2-N-(3-chlorophenyl)-4-N-(3-cyanophenyl)pyridine-2,4-dicarboxamide (CID 109092850) is 2-N-(3-chlorophenyl)-4-N-(3-cyanophenyl)pyridine-2,4-dicarboxamide.
What is the SMILES notation for 2-N-(3-chlorophenyl)-4-N-(3-cyanophenyl)pyridine-2,4-dicarboxamide?
The canonical SMILES for 2-N-(3-chlorophenyl)-4-N-(3-cyanophenyl)pyridine-2,4-dicarboxamide is N#Cc1cccc(NC(=O)c2ccnc(C(=O)Nc3cccc(Cl)c3)c2)c1.
What is the InChIKey of 2-N-(3-chlorophenyl)-4-N-(3-cyanophenyl)pyridine-2,4-dicarboxamide?
The InChIKey is IBVBKJXGCAMHNM-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H13ClN4O2/c21-15-4-2-6-17(11-15)25-20(27)18-10-14(7-8-23-18)19(26)24-16-5-1-3-13(9-16)12-22/h1-11H,(H,24,26)(H,25,27).
What are the key properties of 2-N-(3-chlorophenyl)-4-N-(3-cyanophenyl)pyridine-2,4-dicarboxamide?
2-N-(3-chlorophenyl)-4-N-(3-cyanophenyl)pyridine-2,4-dicarboxamide has a molecular weight of 376.80 g/mol, XLogP of 4.11, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-(3-chlorophenyl)-4-N-(3-cyanophenyl)pyridine-2,4-dicarboxamide is sourced from PubChem (CID 109092850), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).