2-(3-aminophenoxy)-N-(5-fluoro-2-pyridinyl)acetamide

C13H12FN3O2 — CID 65481050

IUPAC2-(3-aminophenoxy)-N-(5-fluoro-2-pyridinyl)acetamide
SMILESNc1cccc(OCC(=O)Nc2ccc(F)cn2)c1
InChIInChI=1S/C13H12FN3O2/c14-9-4-5-12(16-7-9)17-13(18)8-19-11-3-1-2-10(15)6-11/h1-7H,8,15H2,(H,16,17,18)
InChIKeyMYHVTRVJPKIONP-UHFFFAOYSA-N
MW261.26 g/mol
LogP1.82
Rot. Bonds4

About 2-(3-aminophenoxy)-N-(5-fluoro-2-pyridinyl)acetamide

2-(3-aminophenoxy)-N-(5-fluoro-2-pyridinyl)acetamide (PubChem CID 65481050) has the molecular formula C13H12FN3O2 and a molecular weight of 261.26 g/mol. Its IUPAC name is 2-(3-aminophenoxy)-N-(5-fluoro-2-pyridinyl)acetamide.

Molecular Properties

Compound Name2-(3-aminophenoxy)-N-(5-fluoro-2-pyridinyl)acetamide
PubChem CID65481050
Molecular FormulaC13H12FN3O2
Molecular Weight261.26 g/mol
Exact Mass261.09
IUPAC Name2-(3-aminophenoxy)-N-(5-fluoro-2-pyridinyl)acetamide
SMILESNc1cccc(OCC(=O)Nc2ccc(F)cn2)c1
InChIInChI=1S/C13H12FN3O2/c14-9-4-5-12(16-7-9)17-13(18)8-19-11-3-1-2-10(15)6-11/h1-7H,8,15H2,(H,16,17,18)
InChIKeyMYHVTRVJPKIONP-UHFFFAOYSA-N
XLogP1.82
TPSA77.24 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.26
LogP ≤ 51.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

2-(3-aminophenoxy)-N-(2,5-difluorophenyl)acetamide
CID 61034814
N-(5-chloro-2-pyridinyl)-2-(3-fluorophenoxy)acetamide
CID 33327531
2-(3-aminophenoxy)-N-(5-propyl-1H-pyrazol-3-yl)acetamide
CID 104616215
2-(3-aminophenoxy)-N-(thiatriazol-5-yl)acetamide
CID 114911560
2-(3-aminophenoxy)-N-(2,4,6-tribromophenyl)acetamide
CID 61035585
2-(3-aminophenoxy)-N-(2-methylsulfanylphenyl)acetamide
CID 61034938
N-(2-amino-4-fluorophenyl)-2-(3-fluorophenoxy)acetamide
CID 16796146
(E)-3-(3-aminophenyl)-N-(5-fluoro-2-pyridinyl)prop-2-enamide
CID 115344407
2-(3-aminophenoxy)-N-ethylacetamide
CID 16775097
2-(3-aminophenoxy)-N-(2,6-dibromo-4-methylphenyl)acetamide
CID 61035718
2-(3-aminophenoxy)-N-(2,5-dimethylpyrazol-3-yl)acetamide
CID 61090242
2-(3-aminophenoxy)-N-(2,4-dimethylphenyl)acetamide
CID 39107625

Frequently Asked Questions

What is the IUPAC name of 2-(3-aminophenoxy)-N-(5-fluoro-2-pyridinyl)acetamide?
The IUPAC name of 2-(3-aminophenoxy)-N-(5-fluoro-2-pyridinyl)acetamide (CID 65481050) is 2-(3-aminophenoxy)-N-(5-fluoro-2-pyridinyl)acetamide.
What is the SMILES notation for 2-(3-aminophenoxy)-N-(5-fluoro-2-pyridinyl)acetamide?
The canonical SMILES for 2-(3-aminophenoxy)-N-(5-fluoro-2-pyridinyl)acetamide is Nc1cccc(OCC(=O)Nc2ccc(F)cn2)c1.
What is the InChIKey of 2-(3-aminophenoxy)-N-(5-fluoro-2-pyridinyl)acetamide?
The InChIKey is MYHVTRVJPKIONP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12FN3O2/c14-9-4-5-12(16-7-9)17-13(18)8-19-11-3-1-2-10(15)6-11/h1-7H,8,15H2,(H,16,17,18).
What are the key properties of 2-(3-aminophenoxy)-N-(5-fluoro-2-pyridinyl)acetamide?
2-(3-aminophenoxy)-N-(5-fluoro-2-pyridinyl)acetamide has a molecular weight of 261.26 g/mol, XLogP of 1.82, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-aminophenoxy)-N-(5-fluoro-2-pyridinyl)acetamide is sourced from PubChem (CID 65481050), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).