6-[2-(3-chlorophenyl)ethylamino]-N-(2-fluorophenyl)pyridine-3-carboxamide

C20H17ClFN3O — CID 109161942

IUPAC6-[2-(3-chlorophenyl)ethylamino]-N-(2-fluorophenyl)pyridine-3-carboxamide
SMILESO=C(Nc1ccccc1F)c1ccc(NCCc2cccc(Cl)c2)nc1
InChIInChI=1S/C20H17ClFN3O/c21-16-5-3-4-14(12-16)10-11-23-19-9-8-15(13-24-19)20(26)25-18-7-2-1-6-17(18)22/h1-9,12-13H,10-11H2,(H,23,24)(H,25,26)
InChIKeyARTGLTNOLNUECX-UHFFFAOYSA-N
MW369.83 g/mol
LogP4.78
Rot. Bonds6

About 6-[2-(3-chlorophenyl)ethylamino]-N-(2-fluorophenyl)pyridine-3-carboxamide

6-[2-(3-chlorophenyl)ethylamino]-N-(2-fluorophenyl)pyridine-3-carboxamide (PubChem CID 109161942) has the molecular formula C20H17ClFN3O and a molecular weight of 369.83 g/mol. Its IUPAC name is 6-[2-(3-chlorophenyl)ethylamino]-N-(2-fluorophenyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name6-[2-(3-chlorophenyl)ethylamino]-N-(2-fluorophenyl)pyridine-3-carboxamide
PubChem CID109161942
Molecular FormulaC20H17ClFN3O
Molecular Weight369.83 g/mol
Exact Mass369.10
IUPAC Name6-[2-(3-chlorophenyl)ethylamino]-N-(2-fluorophenyl)pyridine-3-carboxamide
SMILESO=C(Nc1ccccc1F)c1ccc(NCCc2cccc(Cl)c2)nc1
InChIInChI=1S/C20H17ClFN3O/c21-16-5-3-4-14(12-16)10-11-23-19-9-8-15(13-24-19)20(26)25-18-7-2-1-6-17(18)22/h1-9,12-13H,10-11H2,(H,23,24)(H,25,26)
InChIKeyARTGLTNOLNUECX-UHFFFAOYSA-N
XLogP4.78
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms26
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.83
LogP ≤ 54.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-[2-(3-chlorophenyl)ethylamino]-N-(2-fluorophenyl)pyridine-3-carboxamide?
The IUPAC name of 6-[2-(3-chlorophenyl)ethylamino]-N-(2-fluorophenyl)pyridine-3-carboxamide (CID 109161942) is 6-[2-(3-chlorophenyl)ethylamino]-N-(2-fluorophenyl)pyridine-3-carboxamide.
What is the SMILES notation for 6-[2-(3-chlorophenyl)ethylamino]-N-(2-fluorophenyl)pyridine-3-carboxamide?
The canonical SMILES for 6-[2-(3-chlorophenyl)ethylamino]-N-(2-fluorophenyl)pyridine-3-carboxamide is O=C(Nc1ccccc1F)c1ccc(NCCc2cccc(Cl)c2)nc1.
What is the InChIKey of 6-[2-(3-chlorophenyl)ethylamino]-N-(2-fluorophenyl)pyridine-3-carboxamide?
The InChIKey is ARTGLTNOLNUECX-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17ClFN3O/c21-16-5-3-4-14(12-16)10-11-23-19-9-8-15(13-24-19)20(26)25-18-7-2-1-6-17(18)22/h1-9,12-13H,10-11H2,(H,23,24)(H,25,26).
What are the key properties of 6-[2-(3-chlorophenyl)ethylamino]-N-(2-fluorophenyl)pyridine-3-carboxamide?
6-[2-(3-chlorophenyl)ethylamino]-N-(2-fluorophenyl)pyridine-3-carboxamide has a molecular weight of 369.83 g/mol, XLogP of 4.78, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[2-(3-chlorophenyl)ethylamino]-N-(2-fluorophenyl)pyridine-3-carboxamide is sourced from PubChem (CID 109161942), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).