2-fluoro-N-(furan-2-ylmethyl)-N-[(4-methoxyphenyl)methyl]benzamide

C20H18FNO3 — CID 4257401

IUPAC2-fluoro-N-(furan-2-ylmethyl)-N-[(4-methoxyphenyl)methyl]benzamide
SMILESCOc1ccc(CN(Cc2ccco2)C(=O)c2ccccc2F)cc1
InChIInChI=1S/C20H18FNO3/c1-24-16-10-8-15(9-11-16)13-22(14-17-5-4-12-25-17)20(23)18-6-2-3-7-19(18)21/h2-12H,13-14H2,1H3
InChIKeyRQDKBNNYJVAKLU-UHFFFAOYSA-N
MW339.37 g/mol
LogP4.27
Rot. Bonds6

About 2-fluoro-N-(furan-2-ylmethyl)-N-[(4-methoxyphenyl)methyl]benzamide

2-fluoro-N-(furan-2-ylmethyl)-N-[(4-methoxyphenyl)methyl]benzamide (PubChem CID 4257401) has the molecular formula C20H18FNO3 and a molecular weight of 339.37 g/mol. Its IUPAC name is 2-fluoro-N-(furan-2-ylmethyl)-N-[(4-methoxyphenyl)methyl]benzamide.

Molecular Properties

Compound Name2-fluoro-N-(furan-2-ylmethyl)-N-[(4-methoxyphenyl)methyl]benzamide
PubChem CID4257401
Molecular FormulaC20H18FNO3
Molecular Weight339.37 g/mol
Exact Mass339.13
IUPAC Name2-fluoro-N-(furan-2-ylmethyl)-N-[(4-methoxyphenyl)methyl]benzamide
SMILESCOc1ccc(CN(Cc2ccco2)C(=O)c2ccccc2F)cc1
InChIInChI=1S/C20H18FNO3/c1-24-16-10-8-15(9-11-16)13-22(14-17-5-4-12-25-17)20(23)18-6-2-3-7-19(18)21/h2-12H,13-14H2,1H3
InChIKeyRQDKBNNYJVAKLU-UHFFFAOYSA-N
XLogP4.27
TPSA42.68 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.37
LogP ≤ 54.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 2-fluoro-N-(furan-2-ylmethyl)-N-[(4-methoxyphenyl)methyl]benzamide 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 2-fluoro-N-(furan-2-ylmethyl)-N-[(4-methoxyphenyl)methyl]benzamide?
The IUPAC name of 2-fluoro-N-(furan-2-ylmethyl)-N-[(4-methoxyphenyl)methyl]benzamide (CID 4257401) is 2-fluoro-N-(furan-2-ylmethyl)-N-[(4-methoxyphenyl)methyl]benzamide.
What is the SMILES notation for 2-fluoro-N-(furan-2-ylmethyl)-N-[(4-methoxyphenyl)methyl]benzamide?
The canonical SMILES for 2-fluoro-N-(furan-2-ylmethyl)-N-[(4-methoxyphenyl)methyl]benzamide is COc1ccc(CN(Cc2ccco2)C(=O)c2ccccc2F)cc1.
What is the InChIKey of 2-fluoro-N-(furan-2-ylmethyl)-N-[(4-methoxyphenyl)methyl]benzamide?
The InChIKey is RQDKBNNYJVAKLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18FNO3/c1-24-16-10-8-15(9-11-16)13-22(14-17-5-4-12-25-17)20(23)18-6-2-3-7-19(18)21/h2-12H,13-14H2,1H3.
What are the key properties of 2-fluoro-N-(furan-2-ylmethyl)-N-[(4-methoxyphenyl)methyl]benzamide?
2-fluoro-N-(furan-2-ylmethyl)-N-[(4-methoxyphenyl)methyl]benzamide has a molecular weight of 339.37 g/mol, XLogP of 4.27, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-N-(furan-2-ylmethyl)-N-[(4-methoxyphenyl)methyl]benzamide is sourced from PubChem (CID 4257401), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).