5-[2-(4-fluorophenyl)ethylamino]-N-phenylpyridine-2-carboxamide

C20H18FN3O — CID 109192413

IUPAC5-[2-(4-fluorophenyl)ethylamino]-N-phenylpyridine-2-carboxamide
SMILESO=C(Nc1ccccc1)c1ccc(NCCc2ccc(F)cc2)cn1
InChIInChI=1S/C20H18FN3O/c21-16-8-6-15(7-9-16)12-13-22-18-10-11-19(23-14-18)20(25)24-17-4-2-1-3-5-17/h1-11,14,22H,12-13H2,(H,24,25)
InChIKeyPAIQBSHJYVODBR-UHFFFAOYSA-N
MW335.38 g/mol
LogP4.13
Rot. Bonds6

About 5-[2-(4-fluorophenyl)ethylamino]-N-phenylpyridine-2-carboxamide

5-[2-(4-fluorophenyl)ethylamino]-N-phenylpyridine-2-carboxamide (PubChem CID 109192413) has the molecular formula C20H18FN3O and a molecular weight of 335.38 g/mol. Its IUPAC name is 5-[2-(4-fluorophenyl)ethylamino]-N-phenylpyridine-2-carboxamide.

Molecular Properties

Compound Name5-[2-(4-fluorophenyl)ethylamino]-N-phenylpyridine-2-carboxamide
PubChem CID109192413
Molecular FormulaC20H18FN3O
Molecular Weight335.38 g/mol
Exact Mass335.14
IUPAC Name5-[2-(4-fluorophenyl)ethylamino]-N-phenylpyridine-2-carboxamide
SMILESO=C(Nc1ccccc1)c1ccc(NCCc2ccc(F)cc2)cn1
InChIInChI=1S/C20H18FN3O/c21-16-8-6-15(7-9-16)12-13-22-18-10-11-19(23-14-18)20(25)24-17-4-2-1-3-5-17/h1-11,14,22H,12-13H2,(H,24,25)
InChIKeyPAIQBSHJYVODBR-UHFFFAOYSA-N
XLogP4.13
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.38
LogP ≤ 54.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(4-fluorophenyl)ethyl]-5-(2-phenylethylamino)pyridine-2-carboxamide
CID 109191849
N-(4-fluorophenyl)-5-(2-phenylethylamino)pyrazine-2-carboxamide
CID 109283961
N-phenyl-5-[2-(4-sulfamoylphenyl)ethylamino]pyridine-2-carboxamide
CID 109193610
N-(4-fluorophenyl)-5-[2-(4-fluorophenyl)ethylamino]pyrazine-2-carboxamide
CID 109284544
N-(4-ethoxyphenyl)-5-[2-(4-fluorophenyl)ethylamino]pyridine-2-carboxamide
CID 109192445
N-[2-(4-fluorophenyl)ethyl]-5-(3-phenylpropylamino)pyridine-2-carboxamide
CID 109192324
N-(3-bromophenyl)-5-(2-phenylethylamino)pyridine-2-carboxamide
CID 109191938
methyl 4-[[5-(2-phenylethylamino)pyridine-2-carbonyl]amino]benzoate
CID 109191932
N-(3-fluorophenyl)-5-(3-phenylpropylamino)pyridine-2-carboxamide
CID 109194940
N-(4-fluorophenyl)-2-(2-phenylethylamino)pyrimidine-4-carboxamide
CID 109307799
5-[2-(4-chlorophenyl)ethylamino]-N-[2-(4-fluorophenyl)ethyl]pyridine-2-carboxamide
CID 109192321
3-[4-[(5-fluoropyridine-2-carbonyl)amino]phenyl]propanoic acid
CID 104638373

Frequently Asked Questions

What is the IUPAC name of 5-[2-(4-fluorophenyl)ethylamino]-N-phenylpyridine-2-carboxamide?
The IUPAC name of 5-[2-(4-fluorophenyl)ethylamino]-N-phenylpyridine-2-carboxamide (CID 109192413) is 5-[2-(4-fluorophenyl)ethylamino]-N-phenylpyridine-2-carboxamide.
What is the SMILES notation for 5-[2-(4-fluorophenyl)ethylamino]-N-phenylpyridine-2-carboxamide?
The canonical SMILES for 5-[2-(4-fluorophenyl)ethylamino]-N-phenylpyridine-2-carboxamide is O=C(Nc1ccccc1)c1ccc(NCCc2ccc(F)cc2)cn1.
What is the InChIKey of 5-[2-(4-fluorophenyl)ethylamino]-N-phenylpyridine-2-carboxamide?
The InChIKey is PAIQBSHJYVODBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18FN3O/c21-16-8-6-15(7-9-16)12-13-22-18-10-11-19(23-14-18)20(25)24-17-4-2-1-3-5-17/h1-11,14,22H,12-13H2,(H,24,25).
What are the key properties of 5-[2-(4-fluorophenyl)ethylamino]-N-phenylpyridine-2-carboxamide?
5-[2-(4-fluorophenyl)ethylamino]-N-phenylpyridine-2-carboxamide has a molecular weight of 335.38 g/mol, XLogP of 4.13, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[2-(4-fluorophenyl)ethylamino]-N-phenylpyridine-2-carboxamide is sourced from PubChem (CID 109192413), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).