5-cyano-4-(2,4-dichlorophenyl)-6-methylpyridine-2-carboxamide

C14H9Cl2N3O — CID 53322742

IUPAC5-cyano-4-(2,4-dichlorophenyl)-6-methylpyridine-2-carboxamide
SMILESCc1nc(C(N)=O)cc(-c2ccc(Cl)cc2Cl)c1C#N
InChIInChI=1S/C14H9Cl2N3O/c1-7-11(6-17)10(5-13(19-7)14(18)20)9-3-2-8(15)4-12(9)16/h2-5H,1H3,(H2,18,20)
InChIKeyZDLKXFGWFXHOQZ-UHFFFAOYSA-N
MW306.15 g/mol
LogP3.33
Rot. Bonds2

About 5-cyano-4-(2,4-dichlorophenyl)-6-methylpyridine-2-carboxamide

5-cyano-4-(2,4-dichlorophenyl)-6-methylpyridine-2-carboxamide (PubChem CID 53322742) has the molecular formula C14H9Cl2N3O and a molecular weight of 306.15 g/mol. Its IUPAC name is 5-cyano-4-(2,4-dichlorophenyl)-6-methylpyridine-2-carboxamide.

Molecular Properties

Compound Name5-cyano-4-(2,4-dichlorophenyl)-6-methylpyridine-2-carboxamide
PubChem CID53322742
Molecular FormulaC14H9Cl2N3O
Molecular Weight306.15 g/mol
Exact Mass305.01
IUPAC Name5-cyano-4-(2,4-dichlorophenyl)-6-methylpyridine-2-carboxamide
SMILESCc1nc(C(N)=O)cc(-c2ccc(Cl)cc2Cl)c1C#N
InChIInChI=1S/C14H9Cl2N3O/c1-7-11(6-17)10(5-13(19-7)14(18)20)9-3-2-8(15)4-12(9)16/h2-5H,1H3,(H2,18,20)
InChIKeyZDLKXFGWFXHOQZ-UHFFFAOYSA-N
XLogP3.33
TPSA79.77 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.15
LogP ≤ 53.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-cyano-4-(furan-2-yl)-6-methylpyridine-2-carboxamide
CID 134085841
2-amino-4-(2,4-dichlorophenyl)-6-(2-methylphenyl)pyridine-3-carbonitrile
CID 5230671
5-cyano-4-(3,5-dichlorophenyl)-6-methylpyridine-2-carboxylic acid
CID 134083096
2-amino-4-(2,4-dichlorophenyl)-6-(2,5-dichlorophenyl)pyridine-3-carbonitrile
CID 3543957
6-(aminomethyl)-4-(2,4-dichlorophenyl)-2-methylpyridine-3-carboxamide
CID 53319951
2-amino-6-(2,4-dichlorophenyl)-4-(2-methylphenyl)pyridine-3-carbonitrile
CID 3389205
4-(2,4-dichlorophenyl)-1,3-dimethylpyrazolo[5,4-b]pyridine-6-carboxylic acid
CID 134085650
2-amino-4-(2,4-dichlorophenyl)-6-(4-ethylphenyl)pyridine-3-carbonitrile
CID 4636737
2-amino-4-(2,4-dichlorophenyl)-6-(4-phenylphenyl)pyridine-3-carbonitrile
CID 4659437
8-(2,4-dichlorophenyl)-1,6-naphthyridine-2-carboxamide
CID 75203010
N-[3-cyano-4-(2,4-dichlorophenyl)thiophen-2-yl]propanamide
CID 2971084
2-amino-4-(2,4-dichlorophenyl)-6-phenylpyridine-3-carbonitrile;2-[(2,4-dichlorophenyl)methylidene]propanedinitrile
CID 161083745

Frequently Asked Questions

What is the IUPAC name of 5-cyano-4-(2,4-dichlorophenyl)-6-methylpyridine-2-carboxamide?
The IUPAC name of 5-cyano-4-(2,4-dichlorophenyl)-6-methylpyridine-2-carboxamide (CID 53322742) is 5-cyano-4-(2,4-dichlorophenyl)-6-methylpyridine-2-carboxamide.
What is the SMILES notation for 5-cyano-4-(2,4-dichlorophenyl)-6-methylpyridine-2-carboxamide?
The canonical SMILES for 5-cyano-4-(2,4-dichlorophenyl)-6-methylpyridine-2-carboxamide is Cc1nc(C(N)=O)cc(-c2ccc(Cl)cc2Cl)c1C#N.
What is the InChIKey of 5-cyano-4-(2,4-dichlorophenyl)-6-methylpyridine-2-carboxamide?
The InChIKey is ZDLKXFGWFXHOQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H9Cl2N3O/c1-7-11(6-17)10(5-13(19-7)14(18)20)9-3-2-8(15)4-12(9)16/h2-5H,1H3,(H2,18,20).
What are the key properties of 5-cyano-4-(2,4-dichlorophenyl)-6-methylpyridine-2-carboxamide?
5-cyano-4-(2,4-dichlorophenyl)-6-methylpyridine-2-carboxamide has a molecular weight of 306.15 g/mol, XLogP of 3.33, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyano-4-(2,4-dichlorophenyl)-6-methylpyridine-2-carboxamide is sourced from PubChem (CID 53322742), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).