2-[(3-fluorophenyl)methoxy]-N-pyridin-3-ylbenzamide

C19H15FN2O2 — CID 118911652

IUPAC2-[(3-fluorophenyl)methoxy]-N-pyridin-3-ylbenzamide
SMILESO=C(Nc1cccnc1)c1ccccc1OCc1cccc(F)c1
InChIInChI=1S/C19H15FN2O2/c20-15-6-3-5-14(11-15)13-24-18-9-2-1-8-17(18)19(23)22-16-7-4-10-21-12-16/h1-12H,13H2,(H,22,23)
InChIKeyANAFAHZDDIMSJV-UHFFFAOYSA-N
MW322.34 g/mol
LogP4.05
Rot. Bonds5

About 2-[(3-fluorophenyl)methoxy]-N-pyridin-3-ylbenzamide

2-[(3-fluorophenyl)methoxy]-N-pyridin-3-ylbenzamide (PubChem CID 118911652) has the molecular formula C19H15FN2O2 and a molecular weight of 322.34 g/mol. Its IUPAC name is 2-[(3-fluorophenyl)methoxy]-N-pyridin-3-ylbenzamide.

Molecular Properties

Compound Name2-[(3-fluorophenyl)methoxy]-N-pyridin-3-ylbenzamide
PubChem CID118911652
Molecular FormulaC19H15FN2O2
Molecular Weight322.34 g/mol
Exact Mass322.11
IUPAC Name2-[(3-fluorophenyl)methoxy]-N-pyridin-3-ylbenzamide
SMILESO=C(Nc1cccnc1)c1ccccc1OCc1cccc(F)c1
InChIInChI=1S/C19H15FN2O2/c20-15-6-3-5-14(11-15)13-24-18-9-2-1-8-17(18)19(23)22-16-7-4-10-21-12-16/h1-12H,13H2,(H,22,23)
InChIKeyANAFAHZDDIMSJV-UHFFFAOYSA-N
XLogP4.05
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.34
LogP ≤ 54.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[(3-fluorophenyl)methoxy]-N-pyridin-3-ylbenzamide?
The IUPAC name of 2-[(3-fluorophenyl)methoxy]-N-pyridin-3-ylbenzamide (CID 118911652) is 2-[(3-fluorophenyl)methoxy]-N-pyridin-3-ylbenzamide.
What is the SMILES notation for 2-[(3-fluorophenyl)methoxy]-N-pyridin-3-ylbenzamide?
The canonical SMILES for 2-[(3-fluorophenyl)methoxy]-N-pyridin-3-ylbenzamide is O=C(Nc1cccnc1)c1ccccc1OCc1cccc(F)c1.
What is the InChIKey of 2-[(3-fluorophenyl)methoxy]-N-pyridin-3-ylbenzamide?
The InChIKey is ANAFAHZDDIMSJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15FN2O2/c20-15-6-3-5-14(11-15)13-24-18-9-2-1-8-17(18)19(23)22-16-7-4-10-21-12-16/h1-12H,13H2,(H,22,23).
What are the key properties of 2-[(3-fluorophenyl)methoxy]-N-pyridin-3-ylbenzamide?
2-[(3-fluorophenyl)methoxy]-N-pyridin-3-ylbenzamide has a molecular weight of 322.34 g/mol, XLogP of 4.05, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3-fluorophenyl)methoxy]-N-pyridin-3-ylbenzamide is sourced from PubChem (CID 118911652), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).