5-[2-(4-chlorophenyl)ethylamino]-N-(2,4-difluorophenyl)pyridine-2-carboxamide

C20H16ClF2N3O — CID 109193713

IUPAC5-[2-(4-chlorophenyl)ethylamino]-N-(2,4-difluorophenyl)pyridine-2-carboxamide
SMILESO=C(Nc1ccc(F)cc1F)c1ccc(NCCc2ccc(Cl)cc2)cn1
InChIInChI=1S/C20H16ClF2N3O/c21-14-3-1-13(2-4-14)9-10-24-16-6-8-19(25-12-16)20(27)26-18-7-5-15(22)11-17(18)23/h1-8,11-12,24H,9-10H2,(H,26,27)
InChIKeyXWUBYEUZUKDDHS-UHFFFAOYSA-N
MW387.82 g/mol
LogP4.92
Rot. Bonds6

About 5-[2-(4-chlorophenyl)ethylamino]-N-(2,4-difluorophenyl)pyridine-2-carboxamide

5-[2-(4-chlorophenyl)ethylamino]-N-(2,4-difluorophenyl)pyridine-2-carboxamide (PubChem CID 109193713) has the molecular formula C20H16ClF2N3O and a molecular weight of 387.82 g/mol. Its IUPAC name is 5-[2-(4-chlorophenyl)ethylamino]-N-(2,4-difluorophenyl)pyridine-2-carboxamide.

Molecular Properties

Compound Name5-[2-(4-chlorophenyl)ethylamino]-N-(2,4-difluorophenyl)pyridine-2-carboxamide
PubChem CID109193713
Molecular FormulaC20H16ClF2N3O
Molecular Weight387.82 g/mol
Exact Mass387.09
IUPAC Name5-[2-(4-chlorophenyl)ethylamino]-N-(2,4-difluorophenyl)pyridine-2-carboxamide
SMILESO=C(Nc1ccc(F)cc1F)c1ccc(NCCc2ccc(Cl)cc2)cn1
InChIInChI=1S/C20H16ClF2N3O/c21-14-3-1-13(2-4-14)9-10-24-16-6-8-19(25-12-16)20(27)26-18-7-5-15(22)11-17(18)23/h1-8,11-12,24H,9-10H2,(H,26,27)
InChIKeyXWUBYEUZUKDDHS-UHFFFAOYSA-N
XLogP4.92
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500387.82
LogP ≤ 54.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(4-chlorophenyl)ethyl]-5-(2,4-difluoroanilino)pyridine-2-carboxamide
CID 109193674
N-(2,4-difluorophenyl)-5-[2-(4-fluorophenyl)ethylamino]pyrazine-2-carboxamide
CID 109284577
5-[2-(4-chlorophenyl)ethylamino]-N-[2-(4-fluorophenyl)ethyl]pyridine-2-carboxamide
CID 109192321
5-[2-(4-fluorophenyl)ethylamino]-N-phenylpyridine-2-carboxamide
CID 109192413
N-[2-(4-chlorophenyl)ethyl]-N'-(2,4-difluorophenyl)oxamide
CID 7541504
N-(2,5-difluorophenyl)-5-(propylamino)pyridine-2-carboxamide
CID 104639737
5-anilino-N-(2,4-difluorophenyl)pyridine-2-carboxamide
CID 109197129
6-[2-(3-chlorophenyl)ethylamino]-N-(2,4-difluorophenyl)pyridazine-3-carboxamide
CID 109126313
N-(2,4-difluorophenyl)-5-(pyridin-2-ylmethylamino)pyridine-2-carboxamide
CID 109191145
N-(2,4-difluorophenyl)-5-(2-morpholin-4-ylethylamino)pyridine-2-carboxamide
CID 109185897
N-(2,4-difluorophenyl)-5-(4-ethylanilino)pyrazine-2-carboxamide
CID 109291695
5-(2,4-difluoroanilino)-N-(4-fluorophenyl)pyridine-2-carboxamide
CID 109198992

Frequently Asked Questions

What is the IUPAC name of 5-[2-(4-chlorophenyl)ethylamino]-N-(2,4-difluorophenyl)pyridine-2-carboxamide?
The IUPAC name of 5-[2-(4-chlorophenyl)ethylamino]-N-(2,4-difluorophenyl)pyridine-2-carboxamide (CID 109193713) is 5-[2-(4-chlorophenyl)ethylamino]-N-(2,4-difluorophenyl)pyridine-2-carboxamide.
What is the SMILES notation for 5-[2-(4-chlorophenyl)ethylamino]-N-(2,4-difluorophenyl)pyridine-2-carboxamide?
The canonical SMILES for 5-[2-(4-chlorophenyl)ethylamino]-N-(2,4-difluorophenyl)pyridine-2-carboxamide is O=C(Nc1ccc(F)cc1F)c1ccc(NCCc2ccc(Cl)cc2)cn1.
What is the InChIKey of 5-[2-(4-chlorophenyl)ethylamino]-N-(2,4-difluorophenyl)pyridine-2-carboxamide?
The InChIKey is XWUBYEUZUKDDHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16ClF2N3O/c21-14-3-1-13(2-4-14)9-10-24-16-6-8-19(25-12-16)20(27)26-18-7-5-15(22)11-17(18)23/h1-8,11-12,24H,9-10H2,(H,26,27).
What are the key properties of 5-[2-(4-chlorophenyl)ethylamino]-N-(2,4-difluorophenyl)pyridine-2-carboxamide?
5-[2-(4-chlorophenyl)ethylamino]-N-(2,4-difluorophenyl)pyridine-2-carboxamide has a molecular weight of 387.82 g/mol, XLogP of 4.92, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[2-(4-chlorophenyl)ethylamino]-N-(2,4-difluorophenyl)pyridine-2-carboxamide is sourced from PubChem (CID 109193713), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).