2-chloro-N-(3,5-dichloro-4-fluorophenyl)-6-ethylpyridine-4-carboxamide

C14H10Cl3FN2O — CID 107573376

IUPAC2-chloro-N-(3,5-dichloro-4-fluorophenyl)-6-ethylpyridine-4-carboxamide
SMILESCCc1cc(C(=O)Nc2cc(Cl)c(F)c(Cl)c2)cc(Cl)n1
InChIInChI=1S/C14H10Cl3FN2O/c1-2-8-3-7(4-12(17)19-8)14(21)20-9-5-10(15)13(18)11(16)6-9/h3-6H,2H2,1H3,(H,20,21)
InChIKeyJZOIKHOCDIVBRV-UHFFFAOYSA-N
MW347.60 g/mol
LogP5.00
Rot. Bonds3

About 2-chloro-N-(3,5-dichloro-4-fluorophenyl)-6-ethylpyridine-4-carboxamide

2-chloro-N-(3,5-dichloro-4-fluorophenyl)-6-ethylpyridine-4-carboxamide (PubChem CID 107573376) has the molecular formula C14H10Cl3FN2O and a molecular weight of 347.60 g/mol. Its IUPAC name is 2-chloro-N-(3,5-dichloro-4-fluorophenyl)-6-ethylpyridine-4-carboxamide.

Molecular Properties

Compound Name2-chloro-N-(3,5-dichloro-4-fluorophenyl)-6-ethylpyridine-4-carboxamide
PubChem CID107573376
Molecular FormulaC14H10Cl3FN2O
Molecular Weight347.60 g/mol
Exact Mass345.98
IUPAC Name2-chloro-N-(3,5-dichloro-4-fluorophenyl)-6-ethylpyridine-4-carboxamide
SMILESCCc1cc(C(=O)Nc2cc(Cl)c(F)c(Cl)c2)cc(Cl)n1
InChIInChI=1S/C14H10Cl3FN2O/c1-2-8-3-7(4-12(17)19-8)14(21)20-9-5-10(15)13(18)11(16)6-9/h3-6H,2H2,1H3,(H,20,21)
InChIKeyJZOIKHOCDIVBRV-UHFFFAOYSA-N
XLogP5.00
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.60
LogP ≤ 55.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}, {'alert_name': 'halogenated_ring_2', 'substructure': 'N/A'}

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Related Compounds

N-(3-bromo-5-methylphenyl)-2-chloro-6-ethylpyridine-4-carboxamide
CID 107582987
2-chloro-6-ethyl-N-(4-hydroxy-2,5-dimethylphenyl)pyridine-4-carboxamide
CID 106954276
2-chloro-6-ethyl-N-(thiadiazol-5-yl)pyridine-4-carboxamide
CID 114912055
2-chloro-6-ethyl-N-(3-methylpentan-3-yl)pyridine-4-carboxamide
CID 114174171
3-bromo-5-chloro-N-(3,5-dichloro-4-fluorophenyl)benzamide
CID 107953792
2-chloro-6-ethyl-N-[(2-methylpropan-2-yl)oxy]pyridine-4-carboxamide
CID 107856458
2-chloro-6-ethyl-N-(6-oxo-1H-pyridazin-3-yl)pyridine-4-carboxamide
CID 116786621
2-chloro-6-ethyl-N-[2-(methylsulfamoyl)ethyl]pyridine-4-carboxamide
CID 114175102
N-(3,5-dichloro-4-fluorophenyl)-4-(methylamino)benzamide
CID 107578422
2-chloro-6-ethyl-N-[(2-hydroxyphenyl)methyl]pyridine-4-carboxamide
CID 114331667
N-(5-amino-5-oxopentyl)-2-chloro-6-ethylpyridine-4-carboxamide
CID 106235383
2-chloro-6-ethyl-N-[(1S)-2-hydroxy-1-phenylethyl]pyridine-4-carboxamide
CID 107862756

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-(3,5-dichloro-4-fluorophenyl)-6-ethylpyridine-4-carboxamide?
The IUPAC name of 2-chloro-N-(3,5-dichloro-4-fluorophenyl)-6-ethylpyridine-4-carboxamide (CID 107573376) is 2-chloro-N-(3,5-dichloro-4-fluorophenyl)-6-ethylpyridine-4-carboxamide.
What is the SMILES notation for 2-chloro-N-(3,5-dichloro-4-fluorophenyl)-6-ethylpyridine-4-carboxamide?
The canonical SMILES for 2-chloro-N-(3,5-dichloro-4-fluorophenyl)-6-ethylpyridine-4-carboxamide is CCc1cc(C(=O)Nc2cc(Cl)c(F)c(Cl)c2)cc(Cl)n1.
What is the InChIKey of 2-chloro-N-(3,5-dichloro-4-fluorophenyl)-6-ethylpyridine-4-carboxamide?
The InChIKey is JZOIKHOCDIVBRV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10Cl3FN2O/c1-2-8-3-7(4-12(17)19-8)14(21)20-9-5-10(15)13(18)11(16)6-9/h3-6H,2H2,1H3,(H,20,21).
What are the key properties of 2-chloro-N-(3,5-dichloro-4-fluorophenyl)-6-ethylpyridine-4-carboxamide?
2-chloro-N-(3,5-dichloro-4-fluorophenyl)-6-ethylpyridine-4-carboxamide has a molecular weight of 347.60 g/mol, XLogP of 5.00, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-(3,5-dichloro-4-fluorophenyl)-6-ethylpyridine-4-carboxamide is sourced from PubChem (CID 107573376), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).