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

C20H18FN3O — CID 113016132

IUPAC2-(3-fluorophenyl)-N-[6-(2-methylanilino)-3-pyridinyl]acetamide
SMILESCc1ccccc1Nc1ccc(NC(=O)Cc2cccc(F)c2)cn1
InChIInChI=1S/C20H18FN3O/c1-14-5-2-3-8-18(14)24-19-10-9-17(13-22-19)23-20(25)12-15-6-4-7-16(21)11-15/h2-11,13H,12H2,1H3,(H,22,24)(H,23,25)
InChIKeyNLVUPSACZMFHMA-UHFFFAOYSA-N
MW335.38 g/mol
LogP4.45
Rot. Bonds5

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

2-(3-fluorophenyl)-N-[6-(2-methylanilino)-3-pyridinyl]acetamide (PubChem CID 113016132) has the molecular formula C20H18FN3O and a molecular weight of 335.38 g/mol. Its IUPAC name is 2-(3-fluorophenyl)-N-[6-(2-methylanilino)-3-pyridinyl]acetamide.

Molecular Properties

Compound Name2-(3-fluorophenyl)-N-[6-(2-methylanilino)-3-pyridinyl]acetamide
PubChem CID113016132
Molecular FormulaC20H18FN3O
Molecular Weight335.38 g/mol
Exact Mass335.14
IUPAC Name2-(3-fluorophenyl)-N-[6-(2-methylanilino)-3-pyridinyl]acetamide
SMILESCc1ccccc1Nc1ccc(NC(=O)Cc2cccc(F)c2)cn1
InChIInChI=1S/C20H18FN3O/c1-14-5-2-3-8-18(14)24-19-10-9-17(13-22-19)23-20(25)12-15-6-4-7-16(21)11-15/h2-11,13H,12H2,1H3,(H,22,24)(H,23,25)
InChIKeyNLVUPSACZMFHMA-UHFFFAOYSA-N
XLogP4.45
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 ≤ 54.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[6-(2,3-dimethylanilino)-3-pyridinyl]-2-(3-fluorophenyl)acetamide
CID 113017296
N-(6-anilino-3-pyridinyl)-2-(3-fluorophenyl)acetamide
CID 113016055
N-[5-(2,5-dimethylanilino)-2-pyridinyl]-2-(3-fluorophenyl)acetamide
CID 113032051
N-[6-(2,5-dichloroanilino)-3-pyridinyl]-2-(3-fluorophenyl)acetamide
CID 113022288
N-[6-(2-methylanilino)-3-pyridinyl]-3-phenylpropanamide
CID 113016114
N-[6-(2,5-dimethylanilino)-3-pyridinyl]-2-phenylacetamide
CID 113016876
N-[6-(2,3-dimethylanilino)-3-pyridinyl]-2-(2-fluorophenyl)acetamide
CID 113017295
N-[6-(2-chloroanilino)-3-pyridinyl]-2-(3-methylphenyl)acetamide
CID 113018452
N-[6-(2,4-dimethylanilino)-3-pyridinyl]-2-(4-fluorophenyl)acetamide
CID 113016779
2-(3-fluorophenyl)-N-[5-(3-methylanilino)-2-pyridinyl]acetamide
CID 113031460
N-[5-(4-acetamidoanilino)-2-pyridinyl]-2-(3-fluorophenyl)acetamide
CID 113035220
N-[5-(4-ethylanilino)-2-pyridinyl]-2-(3-fluorophenyl)acetamide
CID 113032512

Frequently Asked Questions

What is the IUPAC name of 2-(3-fluorophenyl)-N-[6-(2-methylanilino)-3-pyridinyl]acetamide?
The IUPAC name of 2-(3-fluorophenyl)-N-[6-(2-methylanilino)-3-pyridinyl]acetamide (CID 113016132) is 2-(3-fluorophenyl)-N-[6-(2-methylanilino)-3-pyridinyl]acetamide.
What is the SMILES notation for 2-(3-fluorophenyl)-N-[6-(2-methylanilino)-3-pyridinyl]acetamide?
The canonical SMILES for 2-(3-fluorophenyl)-N-[6-(2-methylanilino)-3-pyridinyl]acetamide is Cc1ccccc1Nc1ccc(NC(=O)Cc2cccc(F)c2)cn1.
What is the InChIKey of 2-(3-fluorophenyl)-N-[6-(2-methylanilino)-3-pyridinyl]acetamide?
The InChIKey is NLVUPSACZMFHMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18FN3O/c1-14-5-2-3-8-18(14)24-19-10-9-17(13-22-19)23-20(25)12-15-6-4-7-16(21)11-15/h2-11,13H,12H2,1H3,(H,22,24)(H,23,25).
What are the key properties of 2-(3-fluorophenyl)-N-[6-(2-methylanilino)-3-pyridinyl]acetamide?
2-(3-fluorophenyl)-N-[6-(2-methylanilino)-3-pyridinyl]acetamide has a molecular weight of 335.38 g/mol, XLogP of 4.45, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-fluorophenyl)-N-[6-(2-methylanilino)-3-pyridinyl]acetamide is sourced from PubChem (CID 113016132), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).