5-(2-fluoroanilino)-N-(1-phenylethyl)pyridine-2-carboxamide

C20H18FN3O — CID 109188905

IUPAC5-(2-fluoroanilino)-N-(1-phenylethyl)pyridine-2-carboxamide
SMILESCC(NC(=O)c1ccc(Nc2ccccc2F)cn1)c1ccccc1
InChIInChI=1S/C20H18FN3O/c1-14(15-7-3-2-4-8-15)23-20(25)19-12-11-16(13-22-19)24-18-10-6-5-9-17(18)21/h2-14,24H,1H3,(H,23,25)
InChIKeyWBGSRTRHAAWGSS-UHFFFAOYSA-N
MW335.38 g/mol
LogP4.46
Rot. Bonds5

About 5-(2-fluoroanilino)-N-(1-phenylethyl)pyridine-2-carboxamide

5-(2-fluoroanilino)-N-(1-phenylethyl)pyridine-2-carboxamide (PubChem CID 109188905) has the molecular formula C20H18FN3O and a molecular weight of 335.38 g/mol. Its IUPAC name is 5-(2-fluoroanilino)-N-(1-phenylethyl)pyridine-2-carboxamide.

Molecular Properties

Compound Name5-(2-fluoroanilino)-N-(1-phenylethyl)pyridine-2-carboxamide
PubChem CID109188905
Molecular FormulaC20H18FN3O
Molecular Weight335.38 g/mol
Exact Mass335.14
IUPAC Name5-(2-fluoroanilino)-N-(1-phenylethyl)pyridine-2-carboxamide
SMILESCC(NC(=O)c1ccc(Nc2ccccc2F)cn1)c1ccccc1
InChIInChI=1S/C20H18FN3O/c1-14(15-7-3-2-4-8-15)23-20(25)19-12-11-16(13-22-19)24-18-10-6-5-9-17(18)21/h2-14,24H,1H3,(H,23,25)
InChIKeyWBGSRTRHAAWGSS-UHFFFAOYSA-N
XLogP4.46
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.38
LogP ≤ 54.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

5-(4-chloro-2-methylanilino)-N-(1-phenylethyl)pyridine-2-carboxamide
CID 109188912
5-[2-(2-fluorophenyl)ethylamino]-N-(1-phenylethyl)pyridine-2-carboxamide
CID 109188857
N-tert-butyl-5-(2-fluoroanilino)pyridine-2-carboxamide
CID 109195085
5-(2-fluoroanilino)-N-(4-propan-2-yloxyphenyl)pyridine-2-carboxamide
CID 109198899
N-(2-fluorophenyl)-5-(2-propan-2-ylanilino)pyridine-2-carboxamide
CID 109198647
5-(3-bromoanilino)-N-(1-phenylethyl)pyridine-2-carboxamide
CID 109188944
5-(4-fluoroanilino)-N-(1-phenylethyl)pyrazine-2-carboxamide
CID 109280827
N-(4-acetylphenyl)-5-(2-fluoroanilino)pyridine-2-carboxamide
CID 109198907
5-(2,4-difluoroanilino)-N-(1-phenylethyl)pyrazine-2-carboxamide
CID 109280871
5-(2-fluoroanilino)-N-(2-methoxyethyl)pyridine-2-carboxamide
CID 109183927
N-(2,4-dimethylphenyl)-5-(2-fluoroanilino)pyridine-2-carboxamide
CID 109197955
5-(2-fluoroanilino)-N-[(1R)-1-phenylethyl]-2H-triazole-4-carboxamide
CID 95183687

Frequently Asked Questions

What is the IUPAC name of 5-(2-fluoroanilino)-N-(1-phenylethyl)pyridine-2-carboxamide?
The IUPAC name of 5-(2-fluoroanilino)-N-(1-phenylethyl)pyridine-2-carboxamide (CID 109188905) is 5-(2-fluoroanilino)-N-(1-phenylethyl)pyridine-2-carboxamide.
What is the SMILES notation for 5-(2-fluoroanilino)-N-(1-phenylethyl)pyridine-2-carboxamide?
The canonical SMILES for 5-(2-fluoroanilino)-N-(1-phenylethyl)pyridine-2-carboxamide is CC(NC(=O)c1ccc(Nc2ccccc2F)cn1)c1ccccc1.
What is the InChIKey of 5-(2-fluoroanilino)-N-(1-phenylethyl)pyridine-2-carboxamide?
The InChIKey is WBGSRTRHAAWGSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18FN3O/c1-14(15-7-3-2-4-8-15)23-20(25)19-12-11-16(13-22-19)24-18-10-6-5-9-17(18)21/h2-14,24H,1H3,(H,23,25).
What are the key properties of 5-(2-fluoroanilino)-N-(1-phenylethyl)pyridine-2-carboxamide?
5-(2-fluoroanilino)-N-(1-phenylethyl)pyridine-2-carboxamide has a molecular weight of 335.38 g/mol, XLogP of 4.46, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-fluoroanilino)-N-(1-phenylethyl)pyridine-2-carboxamide is sourced from PubChem (CID 109188905), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).