2-fluoro-N-[(2-methoxy-3-pyridinyl)methyl]-N-(2-phenoxyphenyl)acetamide

C21H19FN2O3 — CID 58029278

IUPAC2-fluoro-N-[(2-methoxy-3-pyridinyl)methyl]-N-(2-phenoxyphenyl)acetamide
SMILESCOc1ncccc1CN(C(=O)CF)c1ccccc1Oc1ccccc1
InChIInChI=1S/C21H19FN2O3/c1-26-21-16(8-7-13-23-21)15-24(20(25)14-22)18-11-5-6-12-19(18)27-17-9-3-2-4-10-17/h2-13H,14-15H2,1H3
InChIKeyUHPXKTGSBSCAQY-UHFFFAOYSA-N
MW366.39 g/mol
LogP4.39
Rot. Bonds7

About 2-fluoro-N-[(2-methoxy-3-pyridinyl)methyl]-N-(2-phenoxyphenyl)acetamide

2-fluoro-N-[(2-methoxy-3-pyridinyl)methyl]-N-(2-phenoxyphenyl)acetamide (PubChem CID 58029278) has the molecular formula C21H19FN2O3 and a molecular weight of 366.39 g/mol. Its IUPAC name is 2-fluoro-N-[(2-methoxy-3-pyridinyl)methyl]-N-(2-phenoxyphenyl)acetamide.

Molecular Properties

Compound Name2-fluoro-N-[(2-methoxy-3-pyridinyl)methyl]-N-(2-phenoxyphenyl)acetamide
PubChem CID58029278
Molecular FormulaC21H19FN2O3
Molecular Weight366.39 g/mol
Exact Mass366.14
IUPAC Name2-fluoro-N-[(2-methoxy-3-pyridinyl)methyl]-N-(2-phenoxyphenyl)acetamide
SMILESCOc1ncccc1CN(C(=O)CF)c1ccccc1Oc1ccccc1
InChIInChI=1S/C21H19FN2O3/c1-26-21-16(8-7-13-23-21)15-24(20(25)14-22)18-11-5-6-12-19(18)27-17-9-3-2-4-10-17/h2-13H,14-15H2,1H3
InChIKeyUHPXKTGSBSCAQY-UHFFFAOYSA-N
XLogP4.39
TPSA51.66 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.39
LogP ≤ 54.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-fluoro-N-[(2-methoxy-3-pyridinyl)methyl]-N-(2-phenoxyphenyl)acetamide?
The IUPAC name of 2-fluoro-N-[(2-methoxy-3-pyridinyl)methyl]-N-(2-phenoxyphenyl)acetamide (CID 58029278) is 2-fluoro-N-[(2-methoxy-3-pyridinyl)methyl]-N-(2-phenoxyphenyl)acetamide.
What is the SMILES notation for 2-fluoro-N-[(2-methoxy-3-pyridinyl)methyl]-N-(2-phenoxyphenyl)acetamide?
The canonical SMILES for 2-fluoro-N-[(2-methoxy-3-pyridinyl)methyl]-N-(2-phenoxyphenyl)acetamide is COc1ncccc1CN(C(=O)CF)c1ccccc1Oc1ccccc1.
What is the InChIKey of 2-fluoro-N-[(2-methoxy-3-pyridinyl)methyl]-N-(2-phenoxyphenyl)acetamide?
The InChIKey is UHPXKTGSBSCAQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H19FN2O3/c1-26-21-16(8-7-13-23-21)15-24(20(25)14-22)18-11-5-6-12-19(18)27-17-9-3-2-4-10-17/h2-13H,14-15H2,1H3.
What are the key properties of 2-fluoro-N-[(2-methoxy-3-pyridinyl)methyl]-N-(2-phenoxyphenyl)acetamide?
2-fluoro-N-[(2-methoxy-3-pyridinyl)methyl]-N-(2-phenoxyphenyl)acetamide has a molecular weight of 366.39 g/mol, XLogP of 4.39, 7 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-N-[(2-methoxy-3-pyridinyl)methyl]-N-(2-phenoxyphenyl)acetamide is sourced from PubChem (CID 58029278), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).