N-[5-(2-fluoroanilino)-2-pyridinyl]-2-phenoxyacetamide

C19H16FN3O2 — CID 113033006

IUPACN-[5-(2-fluoroanilino)-2-pyridinyl]-2-phenoxyacetamide
SMILESO=C(COc1ccccc1)Nc1ccc(Nc2ccccc2F)cn1
InChIInChI=1S/C19H16FN3O2/c20-16-8-4-5-9-17(16)22-14-10-11-18(21-12-14)23-19(24)13-25-15-6-2-1-3-7-15/h1-12,22H,13H2,(H,21,23,24)
InChIKeyOSJLWJLFZBGINR-UHFFFAOYSA-N
MW337.35 g/mol
LogP3.98
Rot. Bonds6

About N-[5-(2-fluoroanilino)-2-pyridinyl]-2-phenoxyacetamide

N-[5-(2-fluoroanilino)-2-pyridinyl]-2-phenoxyacetamide (PubChem CID 113033006) has the molecular formula C19H16FN3O2 and a molecular weight of 337.35 g/mol. Its IUPAC name is N-[5-(2-fluoroanilino)-2-pyridinyl]-2-phenoxyacetamide.

Molecular Properties

Compound NameN-[5-(2-fluoroanilino)-2-pyridinyl]-2-phenoxyacetamide
PubChem CID113033006
Molecular FormulaC19H16FN3O2
Molecular Weight337.35 g/mol
Exact Mass337.12
IUPAC NameN-[5-(2-fluoroanilino)-2-pyridinyl]-2-phenoxyacetamide
SMILESO=C(COc1ccccc1)Nc1ccc(Nc2ccccc2F)cn1
InChIInChI=1S/C19H16FN3O2/c20-16-8-4-5-9-17(16)22-14-10-11-18(21-12-14)23-19(24)13-25-15-6-2-1-3-7-15/h1-12,22H,13H2,(H,21,23,24)
InChIKeyOSJLWJLFZBGINR-UHFFFAOYSA-N
XLogP3.98
TPSA63.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.35
LogP ≤ 53.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[5-(2-ethoxyanilino)-2-pyridinyl]-2-phenoxyacetamide
CID 113034277
2-(4-chlorophenoxy)-N-[5-(2-methylanilino)-2-pyridinyl]acetamide
CID 113031330
2-(4-chlorophenoxy)-N-[5-(2,6-difluoroanilino)-2-pyridinyl]acetamide
CID 113037511
N-[5-(3,4-dimethylanilino)-2-pyridinyl]-2-phenoxyacetamide
CID 113032117
N-[4-(2-fluoroanilino)phenyl]-2-(4-methylphenoxy)acetamide
CID 112986773
N-[5-(4-chloroanilino)-2-pyridinyl]-2-(4-chlorophenoxy)acetamide
CID 113033388
N-(6-fluoro-3-pyridinyl)-2-phenoxyacetamide
CID 103789815
2-(4-methylphenoxy)-N-[5-(2-propan-2-yloxyanilino)-2-pyridinyl]acetamide
CID 113034522
N-[5-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-pyridinyl]-2-phenoxyacetamide
CID 113036240
N-(5-bromo-2-pyridinyl)-2-phenoxyacetamide
CID 780284
2-phenoxy-N-[5-(pyridin-2-ylmethylamino)-2-pyridinyl]acetamide
CID 113027662
4-bromo-N-[5-(2-fluoroanilino)-2-pyridinyl]benzamide
CID 113032990

Frequently Asked Questions

What is the IUPAC name of N-[5-(2-fluoroanilino)-2-pyridinyl]-2-phenoxyacetamide?
The IUPAC name of N-[5-(2-fluoroanilino)-2-pyridinyl]-2-phenoxyacetamide (CID 113033006) is N-[5-(2-fluoroanilino)-2-pyridinyl]-2-phenoxyacetamide.
What is the SMILES notation for N-[5-(2-fluoroanilino)-2-pyridinyl]-2-phenoxyacetamide?
The canonical SMILES for N-[5-(2-fluoroanilino)-2-pyridinyl]-2-phenoxyacetamide is O=C(COc1ccccc1)Nc1ccc(Nc2ccccc2F)cn1.
What is the InChIKey of N-[5-(2-fluoroanilino)-2-pyridinyl]-2-phenoxyacetamide?
The InChIKey is OSJLWJLFZBGINR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16FN3O2/c20-16-8-4-5-9-17(16)22-14-10-11-18(21-12-14)23-19(24)13-25-15-6-2-1-3-7-15/h1-12,22H,13H2,(H,21,23,24).
What are the key properties of N-[5-(2-fluoroanilino)-2-pyridinyl]-2-phenoxyacetamide?
N-[5-(2-fluoroanilino)-2-pyridinyl]-2-phenoxyacetamide has a molecular weight of 337.35 g/mol, XLogP of 3.98, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-(2-fluoroanilino)-2-pyridinyl]-2-phenoxyacetamide is sourced from PubChem (CID 113033006), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).