N-(2,4-dichlorophenyl)-2-(4-fluorophenoxy)pyridine-3-carboxamide

C18H11Cl2FN2O2 — CID 612195

IUPACN-(2,4-dichlorophenyl)-2-(4-fluorophenoxy)pyridine-3-carboxamide
SMILESO=C(Nc1ccc(Cl)cc1Cl)c1cccnc1Oc1ccc(F)cc1
InChIInChI=1S/C18H11Cl2FN2O2/c19-11-3-8-16(15(20)10-11)23-17(24)14-2-1-9-22-18(14)25-13-6-4-12(21)5-7-13/h1-10H,(H,23,24)
InChIKeyVMJPXSAAJLMMHS-UHFFFAOYSA-N
MW377.20 g/mol
LogP5.57
Rot. Bonds4

About N-(2,4-dichlorophenyl)-2-(4-fluorophenoxy)pyridine-3-carboxamide

N-(2,4-dichlorophenyl)-2-(4-fluorophenoxy)pyridine-3-carboxamide (PubChem CID 612195) has the molecular formula C18H11Cl2FN2O2 and a molecular weight of 377.20 g/mol. Its IUPAC name is N-(2,4-dichlorophenyl)-2-(4-fluorophenoxy)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(2,4-dichlorophenyl)-2-(4-fluorophenoxy)pyridine-3-carboxamide
PubChem CID612195
Molecular FormulaC18H11Cl2FN2O2
Molecular Weight377.20 g/mol
Exact Mass376.02
IUPAC NameN-(2,4-dichlorophenyl)-2-(4-fluorophenoxy)pyridine-3-carboxamide
SMILESO=C(Nc1ccc(Cl)cc1Cl)c1cccnc1Oc1ccc(F)cc1
InChIInChI=1S/C18H11Cl2FN2O2/c19-11-3-8-16(15(20)10-11)23-17(24)14-2-1-9-22-18(14)25-13-6-4-12(21)5-7-13/h1-10H,(H,23,24)
InChIKeyVMJPXSAAJLMMHS-UHFFFAOYSA-N
XLogP5.57
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms25
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500377.20
LogP ≤ 55.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2,4-dichlorophenyl)-2-(4-fluorophenoxy)pyridine-3-carboxamide?
The IUPAC name of N-(2,4-dichlorophenyl)-2-(4-fluorophenoxy)pyridine-3-carboxamide (CID 612195) is N-(2,4-dichlorophenyl)-2-(4-fluorophenoxy)pyridine-3-carboxamide.
What is the SMILES notation for N-(2,4-dichlorophenyl)-2-(4-fluorophenoxy)pyridine-3-carboxamide?
The canonical SMILES for N-(2,4-dichlorophenyl)-2-(4-fluorophenoxy)pyridine-3-carboxamide is O=C(Nc1ccc(Cl)cc1Cl)c1cccnc1Oc1ccc(F)cc1.
What is the InChIKey of N-(2,4-dichlorophenyl)-2-(4-fluorophenoxy)pyridine-3-carboxamide?
The InChIKey is VMJPXSAAJLMMHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H11Cl2FN2O2/c19-11-3-8-16(15(20)10-11)23-17(24)14-2-1-9-22-18(14)25-13-6-4-12(21)5-7-13/h1-10H,(H,23,24).
What are the key properties of N-(2,4-dichlorophenyl)-2-(4-fluorophenoxy)pyridine-3-carboxamide?
N-(2,4-dichlorophenyl)-2-(4-fluorophenoxy)pyridine-3-carboxamide has a molecular weight of 377.20 g/mol, XLogP of 5.57, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-dichlorophenyl)-2-(4-fluorophenoxy)pyridine-3-carboxamide is sourced from PubChem (CID 612195), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).