N-[6-(2,5-dichloroanilino)-3-pyridinyl]-2-(3-fluorophenyl)acetamide

C19H14Cl2FN3O — CID 113022288

IUPACN-[6-(2,5-dichloroanilino)-3-pyridinyl]-2-(3-fluorophenyl)acetamide
SMILESO=C(Cc1cccc(F)c1)Nc1ccc(Nc2cc(Cl)ccc2Cl)nc1
InChIInChI=1S/C19H14Cl2FN3O/c20-13-4-6-16(21)17(10-13)25-18-7-5-15(11-23-18)24-19(26)9-12-2-1-3-14(22)8-12/h1-8,10-11H,9H2,(H,23,25)(H,24,26)
InChIKeyJHOLTMUXMOPFLK-UHFFFAOYSA-N
MW390.25 g/mol
LogP5.45
Rot. Bonds5

About N-[6-(2,5-dichloroanilino)-3-pyridinyl]-2-(3-fluorophenyl)acetamide

N-[6-(2,5-dichloroanilino)-3-pyridinyl]-2-(3-fluorophenyl)acetamide (PubChem CID 113022288) has the molecular formula C19H14Cl2FN3O and a molecular weight of 390.25 g/mol. Its IUPAC name is N-[6-(2,5-dichloroanilino)-3-pyridinyl]-2-(3-fluorophenyl)acetamide.

Molecular Properties

Compound NameN-[6-(2,5-dichloroanilino)-3-pyridinyl]-2-(3-fluorophenyl)acetamide
PubChem CID113022288
Molecular FormulaC19H14Cl2FN3O
Molecular Weight390.25 g/mol
Exact Mass389.05
IUPAC NameN-[6-(2,5-dichloroanilino)-3-pyridinyl]-2-(3-fluorophenyl)acetamide
SMILESO=C(Cc1cccc(F)c1)Nc1ccc(Nc2cc(Cl)ccc2Cl)nc1
InChIInChI=1S/C19H14Cl2FN3O/c20-13-4-6-16(21)17(10-13)25-18-7-5-15(11-23-18)24-19(26)9-12-2-1-3-14(22)8-12/h1-8,10-11H,9H2,(H,23,25)(H,24,26)
InChIKeyJHOLTMUXMOPFLK-UHFFFAOYSA-N
XLogP5.45
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500390.25
LogP ≤ 55.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(6-anilino-3-pyridinyl)-2-(3-fluorophenyl)acetamide
CID 113016055
2-(3-fluorophenyl)-N-[6-(2-methylanilino)-3-pyridinyl]acetamide
CID 113016132
N-[6-(2,3-dimethylanilino)-3-pyridinyl]-2-(3-fluorophenyl)acetamide
CID 113017296
N-[6-(3-chloro-4-methoxyanilino)-3-pyridinyl]-2-(3-fluorophenyl)acetamide
CID 113019115
N-[6-(2-chloroanilino)-3-pyridinyl]-2-(3-methylphenyl)acetamide
CID 113018452
N-[6-(3,4-dichloroanilino)-3-pyridinyl]-2-(3-methylphenyl)acetamide
CID 113022187
N-[6-(cyclohexylamino)-3-pyridinyl]-2-(3-fluorophenyl)acetamide
CID 113010094
N-[5-(4-acetamidoanilino)-2-pyridinyl]-2-(3-fluorophenyl)acetamide
CID 113035220
N-[5-(4-ethylanilino)-2-pyridinyl]-2-(3-fluorophenyl)acetamide
CID 113032512
2-(4-chlorophenyl)-N-[6-(2,3,4-trifluoroanilino)-3-pyridinyl]acetamide
CID 113023060
N-[6-(2,5-dichloroanilino)-3-pyridinyl]cyclopropanecarboxamide
CID 113022258
2-(3-fluorophenyl)-N-[5-(3-methylanilino)-2-pyridinyl]acetamide
CID 113031460

Frequently Asked Questions

What is the IUPAC name of N-[6-(2,5-dichloroanilino)-3-pyridinyl]-2-(3-fluorophenyl)acetamide?
The IUPAC name of N-[6-(2,5-dichloroanilino)-3-pyridinyl]-2-(3-fluorophenyl)acetamide (CID 113022288) is N-[6-(2,5-dichloroanilino)-3-pyridinyl]-2-(3-fluorophenyl)acetamide.
What is the SMILES notation for N-[6-(2,5-dichloroanilino)-3-pyridinyl]-2-(3-fluorophenyl)acetamide?
The canonical SMILES for N-[6-(2,5-dichloroanilino)-3-pyridinyl]-2-(3-fluorophenyl)acetamide is O=C(Cc1cccc(F)c1)Nc1ccc(Nc2cc(Cl)ccc2Cl)nc1.
What is the InChIKey of N-[6-(2,5-dichloroanilino)-3-pyridinyl]-2-(3-fluorophenyl)acetamide?
The InChIKey is JHOLTMUXMOPFLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14Cl2FN3O/c20-13-4-6-16(21)17(10-13)25-18-7-5-15(11-23-18)24-19(26)9-12-2-1-3-14(22)8-12/h1-8,10-11H,9H2,(H,23,25)(H,24,26).
What are the key properties of N-[6-(2,5-dichloroanilino)-3-pyridinyl]-2-(3-fluorophenyl)acetamide?
N-[6-(2,5-dichloroanilino)-3-pyridinyl]-2-(3-fluorophenyl)acetamide has a molecular weight of 390.25 g/mol, XLogP of 5.45, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-(2,5-dichloroanilino)-3-pyridinyl]-2-(3-fluorophenyl)acetamide is sourced from PubChem (CID 113022288), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).