4-[(3-fluorophenyl)methoxy]-3-methoxy-N-pyridin-3-ylbenzamide

C20H17FN2O3 — CID 23850489

IUPAC4-[(3-fluorophenyl)methoxy]-3-methoxy-N-pyridin-3-ylbenzamide
SMILESCOc1cc(C(=O)Nc2cccnc2)ccc1OCc1cccc(F)c1
InChIInChI=1S/C20H17FN2O3/c1-25-19-11-15(20(24)23-17-6-3-9-22-12-17)7-8-18(19)26-13-14-4-2-5-16(21)10-14/h2-12H,13H2,1H3,(H,23,24)
InChIKeyWBHHBOPRRUKEEY-UHFFFAOYSA-N
MW352.37 g/mol
LogP4.06
Rot. Bonds6

About 4-[(3-fluorophenyl)methoxy]-3-methoxy-N-pyridin-3-ylbenzamide

4-[(3-fluorophenyl)methoxy]-3-methoxy-N-pyridin-3-ylbenzamide (PubChem CID 23850489) has the molecular formula C20H17FN2O3 and a molecular weight of 352.37 g/mol. Its IUPAC name is 4-[(3-fluorophenyl)methoxy]-3-methoxy-N-pyridin-3-ylbenzamide.

Molecular Properties

Compound Name4-[(3-fluorophenyl)methoxy]-3-methoxy-N-pyridin-3-ylbenzamide
PubChem CID23850489
Molecular FormulaC20H17FN2O3
Molecular Weight352.37 g/mol
Exact Mass352.12
IUPAC Name4-[(3-fluorophenyl)methoxy]-3-methoxy-N-pyridin-3-ylbenzamide
SMILESCOc1cc(C(=O)Nc2cccnc2)ccc1OCc1cccc(F)c1
InChIInChI=1S/C20H17FN2O3/c1-25-19-11-15(20(24)23-17-6-3-9-22-12-17)7-8-18(19)26-13-14-4-2-5-16(21)10-14/h2-12H,13H2,1H3,(H,23,24)
InChIKeyWBHHBOPRRUKEEY-UHFFFAOYSA-N
XLogP4.06
TPSA60.45 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.37
LogP ≤ 54.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 4-[(3-fluorophenyl)methoxy]-3-methoxy-N-pyridin-3-ylbenzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-[(3-fluorophenyl)methoxy]-3-methoxy-N-pyridin-3-ylbenzamide?
The IUPAC name of 4-[(3-fluorophenyl)methoxy]-3-methoxy-N-pyridin-3-ylbenzamide (CID 23850489) is 4-[(3-fluorophenyl)methoxy]-3-methoxy-N-pyridin-3-ylbenzamide.
What is the SMILES notation for 4-[(3-fluorophenyl)methoxy]-3-methoxy-N-pyridin-3-ylbenzamide?
The canonical SMILES for 4-[(3-fluorophenyl)methoxy]-3-methoxy-N-pyridin-3-ylbenzamide is COc1cc(C(=O)Nc2cccnc2)ccc1OCc1cccc(F)c1.
What is the InChIKey of 4-[(3-fluorophenyl)methoxy]-3-methoxy-N-pyridin-3-ylbenzamide?
The InChIKey is WBHHBOPRRUKEEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17FN2O3/c1-25-19-11-15(20(24)23-17-6-3-9-22-12-17)7-8-18(19)26-13-14-4-2-5-16(21)10-14/h2-12H,13H2,1H3,(H,23,24).
What are the key properties of 4-[(3-fluorophenyl)methoxy]-3-methoxy-N-pyridin-3-ylbenzamide?
4-[(3-fluorophenyl)methoxy]-3-methoxy-N-pyridin-3-ylbenzamide has a molecular weight of 352.37 g/mol, XLogP of 4.06, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(3-fluorophenyl)methoxy]-3-methoxy-N-pyridin-3-ylbenzamide is sourced from PubChem (CID 23850489), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).