N-[6-(2-cyanoanilino)-3-pyridinyl]-2-(2-fluorophenyl)acetamide

C20H15FN4O — CID 113022689

IUPACN-[6-(2-cyanoanilino)-3-pyridinyl]-2-(2-fluorophenyl)acetamide
SMILESN#Cc1ccccc1Nc1ccc(NC(=O)Cc2ccccc2F)cn1
InChIInChI=1S/C20H15FN4O/c21-17-7-3-1-5-14(17)11-20(26)24-16-9-10-19(23-13-16)25-18-8-4-2-6-15(18)12-22/h1-10,13H,11H2,(H,23,25)(H,24,26)
InChIKeyHHHPNFOFTSLARU-UHFFFAOYSA-N
MW346.37 g/mol
LogP4.02
Rot. Bonds5

About N-[6-(2-cyanoanilino)-3-pyridinyl]-2-(2-fluorophenyl)acetamide

N-[6-(2-cyanoanilino)-3-pyridinyl]-2-(2-fluorophenyl)acetamide (PubChem CID 113022689) has the molecular formula C20H15FN4O and a molecular weight of 346.37 g/mol. Its IUPAC name is N-[6-(2-cyanoanilino)-3-pyridinyl]-2-(2-fluorophenyl)acetamide.

Molecular Properties

Compound NameN-[6-(2-cyanoanilino)-3-pyridinyl]-2-(2-fluorophenyl)acetamide
PubChem CID113022689
Molecular FormulaC20H15FN4O
Molecular Weight346.37 g/mol
Exact Mass346.12
IUPAC NameN-[6-(2-cyanoanilino)-3-pyridinyl]-2-(2-fluorophenyl)acetamide
SMILESN#Cc1ccccc1Nc1ccc(NC(=O)Cc2ccccc2F)cn1
InChIInChI=1S/C20H15FN4O/c21-17-7-3-1-5-14(17)11-20(26)24-16-9-10-19(23-13-16)25-18-8-4-2-6-15(18)12-22/h1-10,13H,11H2,(H,23,25)(H,24,26)
InChIKeyHHHPNFOFTSLARU-UHFFFAOYSA-N
XLogP4.02
TPSA77.81 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.37
LogP ≤ 54.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[6-(2-cyanoanilino)pyridazin-3-yl]-2-(2-fluorophenyl)acetamide
CID 113051142
N-[6-(4-fluoroanilino)-3-pyridinyl]-2-(2-fluorophenyl)acetamide
CID 113018345
2-(2-fluorophenyl)-N-[6-(2,3,4-trifluoroanilino)-3-pyridinyl]acetamide
CID 113023074
N-[6-(2,3-dimethylanilino)-3-pyridinyl]-2-(2-fluorophenyl)acetamide
CID 113017295
N-[6-(2-cyanoanilino)-3-pyridinyl]-2-(3-methylphenyl)acetamide
CID 113022692
N-[6-(2,6-dimethylanilino)-3-pyridinyl]-2-(2-fluorophenyl)acetamide
CID 113017196
N-[6-(2-fluoroanilino)-3-pyridinyl]-2-(4-methylphenyl)acetamide
CID 113018239
N-[5-(2-cyanoanilino)-2-pyridinyl]-4-fluorobenzamide
CID 113037053
2-(2-fluorophenyl)-N-[6-(2-methylpropylamino)-3-pyridinyl]acetamide
CID 113009631
N-[6-(2-fluoroanilino)-3-pyridinyl]-2-thiophen-2-ylacetamide
CID 113018213
2-(2-fluorophenyl)-N-(6-methyl-3-pyridinyl)acetamide
CID 112532440
N-[5-(2-cyanoanilino)-2-pyridinyl]-3-phenylpropanamide
CID 113037072

Frequently Asked Questions

What is the IUPAC name of N-[6-(2-cyanoanilino)-3-pyridinyl]-2-(2-fluorophenyl)acetamide?
The IUPAC name of N-[6-(2-cyanoanilino)-3-pyridinyl]-2-(2-fluorophenyl)acetamide (CID 113022689) is N-[6-(2-cyanoanilino)-3-pyridinyl]-2-(2-fluorophenyl)acetamide.
What is the SMILES notation for N-[6-(2-cyanoanilino)-3-pyridinyl]-2-(2-fluorophenyl)acetamide?
The canonical SMILES for N-[6-(2-cyanoanilino)-3-pyridinyl]-2-(2-fluorophenyl)acetamide is N#Cc1ccccc1Nc1ccc(NC(=O)Cc2ccccc2F)cn1.
What is the InChIKey of N-[6-(2-cyanoanilino)-3-pyridinyl]-2-(2-fluorophenyl)acetamide?
The InChIKey is HHHPNFOFTSLARU-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H15FN4O/c21-17-7-3-1-5-14(17)11-20(26)24-16-9-10-19(23-13-16)25-18-8-4-2-6-15(18)12-22/h1-10,13H,11H2,(H,23,25)(H,24,26).
What are the key properties of N-[6-(2-cyanoanilino)-3-pyridinyl]-2-(2-fluorophenyl)acetamide?
N-[6-(2-cyanoanilino)-3-pyridinyl]-2-(2-fluorophenyl)acetamide has a molecular weight of 346.37 g/mol, XLogP of 4.02, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-(2-cyanoanilino)-3-pyridinyl]-2-(2-fluorophenyl)acetamide is sourced from PubChem (CID 113022689), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).