2-(3-chlorophenoxy)-N-(6-fluoro-2-pyridinyl)acetamide

C13H10ClFN2O2 — CID 104820485

IUPAC2-(3-chlorophenoxy)-N-(6-fluoro-2-pyridinyl)acetamide
SMILESO=C(COc1cccc(Cl)c1)Nc1cccc(F)n1
InChIInChI=1S/C13H10ClFN2O2/c14-9-3-1-4-10(7-9)19-8-13(18)17-12-6-2-5-11(15)16-12/h1-7H,8H2,(H,16,17,18)
InChIKeyYYGJILXHFHAPDN-UHFFFAOYSA-N
MW280.69 g/mol
LogP2.89
Rot. Bonds4

About 2-(3-chlorophenoxy)-N-(6-fluoro-2-pyridinyl)acetamide

2-(3-chlorophenoxy)-N-(6-fluoro-2-pyridinyl)acetamide (PubChem CID 104820485) has the molecular formula C13H10ClFN2O2 and a molecular weight of 280.69 g/mol. Its IUPAC name is 2-(3-chlorophenoxy)-N-(6-fluoro-2-pyridinyl)acetamide.

Molecular Properties

Compound Name2-(3-chlorophenoxy)-N-(6-fluoro-2-pyridinyl)acetamide
PubChem CID104820485
Molecular FormulaC13H10ClFN2O2
Molecular Weight280.69 g/mol
Exact Mass280.04
IUPAC Name2-(3-chlorophenoxy)-N-(6-fluoro-2-pyridinyl)acetamide
SMILESO=C(COc1cccc(Cl)c1)Nc1cccc(F)n1
InChIInChI=1S/C13H10ClFN2O2/c14-9-3-1-4-10(7-9)19-8-13(18)17-12-6-2-5-11(15)16-12/h1-7H,8H2,(H,16,17,18)
InChIKeyYYGJILXHFHAPDN-UHFFFAOYSA-N
XLogP2.89
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.69
LogP ≤ 52.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

2-(3-chlorophenoxy)-N-(6-fluoro-2-pyridinyl)propanamide
CID 104820692
2-(3-chlorophenoxy)-N-(2,3,4-trifluorophenyl)acetamide
CID 2633081
2-(4-chlorophenoxy)-N-[6-[[2-(4-chlorophenoxy)acetyl]amino]-2-pyridinyl]acetamide
CID 1012475
2-(3-chlorophenoxy)-N-(5-methyl-1,2-oxazol-3-yl)acetamide
CID 2632943
N-(5-chloro-2-pyridinyl)-2-(3-fluorophenoxy)acetamide
CID 33327531
N-(4-chloro-2-methylphenyl)-2-(3-chlorophenoxy)acetamide
CID 2707661
[2-(5-chloro-2-fluoroanilino)-2-oxoethyl] 2-(3-chlorophenoxy)acetate
CID 7803669
2-(3-chlorophenoxy)-N-[4-(difluoromethoxy)phenyl]acetamide
CID 7858810
2-(3-chlorophenoxy)-N-(3-ethoxy-1H-1,2,4-triazol-5-yl)acetamide
CID 104818243
N-[2-(chloromethyl)phenyl]-2-(3-chlorophenoxy)acetamide
CID 114298101
N'-[2-(3-chlorophenoxy)acetyl]-4-fluorobenzohydrazide
CID 9340581
2-(3-chlorophenoxy)-N-(3,5-dimethyl-1H-pyrazol-4-yl)acetamide
CID 43397496

Frequently Asked Questions

What is the IUPAC name of 2-(3-chlorophenoxy)-N-(6-fluoro-2-pyridinyl)acetamide?
The IUPAC name of 2-(3-chlorophenoxy)-N-(6-fluoro-2-pyridinyl)acetamide (CID 104820485) is 2-(3-chlorophenoxy)-N-(6-fluoro-2-pyridinyl)acetamide.
What is the SMILES notation for 2-(3-chlorophenoxy)-N-(6-fluoro-2-pyridinyl)acetamide?
The canonical SMILES for 2-(3-chlorophenoxy)-N-(6-fluoro-2-pyridinyl)acetamide is O=C(COc1cccc(Cl)c1)Nc1cccc(F)n1.
What is the InChIKey of 2-(3-chlorophenoxy)-N-(6-fluoro-2-pyridinyl)acetamide?
The InChIKey is YYGJILXHFHAPDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10ClFN2O2/c14-9-3-1-4-10(7-9)19-8-13(18)17-12-6-2-5-11(15)16-12/h1-7H,8H2,(H,16,17,18).
What are the key properties of 2-(3-chlorophenoxy)-N-(6-fluoro-2-pyridinyl)acetamide?
2-(3-chlorophenoxy)-N-(6-fluoro-2-pyridinyl)acetamide has a molecular weight of 280.69 g/mol, XLogP of 2.89, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-chlorophenoxy)-N-(6-fluoro-2-pyridinyl)acetamide is sourced from PubChem (CID 104820485), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).