5-(2-fluorophenyl)-N-(2-phenylethyl)pyridine-3-carboxamide

C20H17FN2O — CID 46033116

IUPAC5-(2-fluorophenyl)-N-(2-phenylethyl)pyridine-3-carboxamide
SMILESO=C(NCCc1ccccc1)c1cncc(-c2ccccc2F)c1
InChIInChI=1S/C20H17FN2O/c21-19-9-5-4-8-18(19)16-12-17(14-22-13-16)20(24)23-11-10-15-6-2-1-3-7-15/h1-9,12-14H,10-11H2,(H,23,24)
InChIKeyBUAVGYHVJRSXCN-UHFFFAOYSA-N
MW320.37 g/mol
LogP3.86
Rot. Bonds5

About 5-(2-fluorophenyl)-N-(2-phenylethyl)pyridine-3-carboxamide

5-(2-fluorophenyl)-N-(2-phenylethyl)pyridine-3-carboxamide (PubChem CID 46033116) has the molecular formula C20H17FN2O and a molecular weight of 320.37 g/mol. Its IUPAC name is 5-(2-fluorophenyl)-N-(2-phenylethyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name5-(2-fluorophenyl)-N-(2-phenylethyl)pyridine-3-carboxamide
PubChem CID46033116
Molecular FormulaC20H17FN2O
Molecular Weight320.37 g/mol
Exact Mass320.13
IUPAC Name5-(2-fluorophenyl)-N-(2-phenylethyl)pyridine-3-carboxamide
SMILESO=C(NCCc1ccccc1)c1cncc(-c2ccccc2F)c1
InChIInChI=1S/C20H17FN2O/c21-19-9-5-4-8-18(19)16-12-17(14-22-13-16)20(24)23-11-10-15-6-2-1-3-7-15/h1-9,12-14H,10-11H2,(H,23,24)
InChIKeyBUAVGYHVJRSXCN-UHFFFAOYSA-N
XLogP3.86
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.37
LogP ≤ 53.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-N-(2-fluorophenyl)-3-N-(2-phenylethyl)pyridine-3,5-dicarboxamide
CID 109106222
N-[3-[4-(2-fluorophenyl)phenyl]propyl]-5-methylpyridine-3-carboxamide
CID 138674657
5-(2,4-difluoroanilino)-N-(2-phenylethyl)pyridine-3-carboxamide
CID 109235876
5-N-(3-fluorophenyl)-3-N-(2-phenylethyl)pyridine-3,5-dicarboxamide
CID 109106241
3-N-(2-phenylethyl)-5-N-prop-2-enylpyridine-3,5-dicarboxamide
CID 109101755
5-N-[2-(dimethylamino)ethyl]-3-N-(2-phenylethyl)pyridine-3,5-dicarboxamide
CID 109104046
3-N-(2-phenylethyl)-5-N-propan-2-ylpyridine-3,5-dicarboxamide
CID 109101366
5-(4-bromoanilino)-N-(2-phenylethyl)pyridine-3-carboxamide
CID 109235844
3-N-[2-(4-fluorophenyl)ethyl]-5-N-phenylpyridine-3,5-dicarboxamide
CID 109106358
5-(N-methylanilino)-N-(2-phenylethyl)pyridine-3-carboxamide
CID 109235813
5-N-(4-acetylphenyl)-3-N-(2-phenylethyl)pyridine-3,5-dicarboxamide
CID 109106239
5-(2-fluoroanilino)-N-(3-phenylpropyl)pyridine-3-carboxamide
CID 109239035

Frequently Asked Questions

What is the IUPAC name of 5-(2-fluorophenyl)-N-(2-phenylethyl)pyridine-3-carboxamide?
The IUPAC name of 5-(2-fluorophenyl)-N-(2-phenylethyl)pyridine-3-carboxamide (CID 46033116) is 5-(2-fluorophenyl)-N-(2-phenylethyl)pyridine-3-carboxamide.
What is the SMILES notation for 5-(2-fluorophenyl)-N-(2-phenylethyl)pyridine-3-carboxamide?
The canonical SMILES for 5-(2-fluorophenyl)-N-(2-phenylethyl)pyridine-3-carboxamide is O=C(NCCc1ccccc1)c1cncc(-c2ccccc2F)c1.
What is the InChIKey of 5-(2-fluorophenyl)-N-(2-phenylethyl)pyridine-3-carboxamide?
The InChIKey is BUAVGYHVJRSXCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17FN2O/c21-19-9-5-4-8-18(19)16-12-17(14-22-13-16)20(24)23-11-10-15-6-2-1-3-7-15/h1-9,12-14H,10-11H2,(H,23,24).
What are the key properties of 5-(2-fluorophenyl)-N-(2-phenylethyl)pyridine-3-carboxamide?
5-(2-fluorophenyl)-N-(2-phenylethyl)pyridine-3-carboxamide has a molecular weight of 320.37 g/mol, XLogP of 3.86, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-fluorophenyl)-N-(2-phenylethyl)pyridine-3-carboxamide is sourced from PubChem (CID 46033116), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).