2,6-dichloro-N-(2-ethylphenyl)pyridine-4-carboxamide

C14H12Cl2N2O — CID 26208762

IUPAC2,6-dichloro-N-(2-ethylphenyl)pyridine-4-carboxamide
SMILESCCc1ccccc1NC(=O)c1cc(Cl)nc(Cl)c1
InChIInChI=1S/C14H12Cl2N2O/c1-2-9-5-3-4-6-11(9)17-14(19)10-7-12(15)18-13(16)8-10/h3-8H,2H2,1H3,(H,17,19)
InChIKeyXXLKTISGYRYGPH-UHFFFAOYSA-N
MW295.17 g/mol
LogP4.20
Rot. Bonds3

About 2,6-dichloro-N-(2-ethylphenyl)pyridine-4-carboxamide

2,6-dichloro-N-(2-ethylphenyl)pyridine-4-carboxamide (PubChem CID 26208762) has the molecular formula C14H12Cl2N2O and a molecular weight of 295.17 g/mol. Its IUPAC name is 2,6-dichloro-N-(2-ethylphenyl)pyridine-4-carboxamide.

Molecular Properties

Compound Name2,6-dichloro-N-(2-ethylphenyl)pyridine-4-carboxamide
PubChem CID26208762
Molecular FormulaC14H12Cl2N2O
Molecular Weight295.17 g/mol
Exact Mass294.03
IUPAC Name2,6-dichloro-N-(2-ethylphenyl)pyridine-4-carboxamide
SMILESCCc1ccccc1NC(=O)c1cc(Cl)nc(Cl)c1
InChIInChI=1S/C14H12Cl2N2O/c1-2-9-5-3-4-6-11(9)17-14(19)10-7-12(15)18-13(16)8-10/h3-8H,2H2,1H3,(H,17,19)
InChIKeyXXLKTISGYRYGPH-UHFFFAOYSA-N
XLogP4.20
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.17
LogP ≤ 54.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

2-chloro-N-(2-ethylphenyl)-6-methylpyridine-4-carboxamide
CID 113378289
6-chloro-N-(2-ethylphenyl)-2-methylpyrimidine-4-carboxamide
CID 75538748
2-chloro-N-(2-ethylphenyl)-6-methylpyrimidine-4-carboxamide
CID 114219422
2-chloro-N-[2-(methoxymethyl)phenyl]-6-(methylamino)pyridine-4-carboxamide
CID 62178501
2-N,4-N-bis(2-ethylphenyl)pyridine-2,4-dicarboxamide
CID 109092181
6-chloro-N-(2-ethylphenyl)pyridazine-3-carboxamide
CID 60859186
2-chloro-N-(2-propylphenyl)pyridine-4-carboxamide
CID 31870056
2-amino-6-chloro-N-(2,6-diethylphenyl)pyridine-4-carboxamide
CID 62153038
3-chloro-4,5-diethoxy-N-(2-ethylphenyl)benzamide
CID 5217703
N-[2-(chloromethyl)phenyl]-3,5-dimethylbenzamide
CID 114298542
3,5-dichloro-N-[2-(ethylaminomethyl)phenyl]benzamide
CID 43601335
5-N-(3-chloro-2-methylphenyl)-3-N-(2-ethylphenyl)pyridine-3,5-dicarboxamide
CID 109108471

Frequently Asked Questions

What is the IUPAC name of 2,6-dichloro-N-(2-ethylphenyl)pyridine-4-carboxamide?
The IUPAC name of 2,6-dichloro-N-(2-ethylphenyl)pyridine-4-carboxamide (CID 26208762) is 2,6-dichloro-N-(2-ethylphenyl)pyridine-4-carboxamide.
What is the SMILES notation for 2,6-dichloro-N-(2-ethylphenyl)pyridine-4-carboxamide?
The canonical SMILES for 2,6-dichloro-N-(2-ethylphenyl)pyridine-4-carboxamide is CCc1ccccc1NC(=O)c1cc(Cl)nc(Cl)c1.
What is the InChIKey of 2,6-dichloro-N-(2-ethylphenyl)pyridine-4-carboxamide?
The InChIKey is XXLKTISGYRYGPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12Cl2N2O/c1-2-9-5-3-4-6-11(9)17-14(19)10-7-12(15)18-13(16)8-10/h3-8H,2H2,1H3,(H,17,19).
What are the key properties of 2,6-dichloro-N-(2-ethylphenyl)pyridine-4-carboxamide?
2,6-dichloro-N-(2-ethylphenyl)pyridine-4-carboxamide has a molecular weight of 295.17 g/mol, XLogP of 4.20, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dichloro-N-(2-ethylphenyl)pyridine-4-carboxamide is sourced from PubChem (CID 26208762), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).