N-[[3-(furan-2-ylmethoxymethyl)phenyl]methyl]-3-(4-methylphenyl)propanamide

C23H25NO3 — CID 55661006

IUPACN-[[3-(furan-2-ylmethoxymethyl)phenyl]methyl]-3-(4-methylphenyl)propanamide
SMILESCc1ccc(CCC(=O)NCc2cccc(COCc3ccco3)c2)cc1
InChIInChI=1S/C23H25NO3/c1-18-7-9-19(10-8-18)11-12-23(25)24-15-20-4-2-5-21(14-20)16-26-17-22-6-3-13-27-22/h2-10,13-14H,11-12,15-17H2,1H3,(H,24,25)
InChIKeyZDQPJGYVJPJGIV-UHFFFAOYSA-N
MW363.46 g/mol
LogP4.55
Rot. Bonds9

About N-[[3-(furan-2-ylmethoxymethyl)phenyl]methyl]-3-(4-methylphenyl)propanamide

N-[[3-(furan-2-ylmethoxymethyl)phenyl]methyl]-3-(4-methylphenyl)propanamide (PubChem CID 55661006) has the molecular formula C23H25NO3 and a molecular weight of 363.46 g/mol. Its IUPAC name is N-[[3-(furan-2-ylmethoxymethyl)phenyl]methyl]-3-(4-methylphenyl)propanamide.

Molecular Properties

Compound NameN-[[3-(furan-2-ylmethoxymethyl)phenyl]methyl]-3-(4-methylphenyl)propanamide
PubChem CID55661006
Molecular FormulaC23H25NO3
Molecular Weight363.46 g/mol
Exact Mass363.18
IUPAC NameN-[[3-(furan-2-ylmethoxymethyl)phenyl]methyl]-3-(4-methylphenyl)propanamide
SMILESCc1ccc(CCC(=O)NCc2cccc(COCc3ccco3)c2)cc1
InChIInChI=1S/C23H25NO3/c1-18-7-9-19(10-8-18)11-12-23(25)24-15-20-4-2-5-21(14-20)16-26-17-22-6-3-13-27-22/h2-10,13-14H,11-12,15-17H2,1H3,(H,24,25)
InChIKeyZDQPJGYVJPJGIV-UHFFFAOYSA-N
XLogP4.55
TPSA51.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms27
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.46
LogP ≤ 54.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[[3-(furan-2-ylmethoxymethyl)phenyl]methyl]-3-(4-methylphenyl)propanamide?
The IUPAC name of N-[[3-(furan-2-ylmethoxymethyl)phenyl]methyl]-3-(4-methylphenyl)propanamide (CID 55661006) is N-[[3-(furan-2-ylmethoxymethyl)phenyl]methyl]-3-(4-methylphenyl)propanamide.
What is the SMILES notation for N-[[3-(furan-2-ylmethoxymethyl)phenyl]methyl]-3-(4-methylphenyl)propanamide?
The canonical SMILES for N-[[3-(furan-2-ylmethoxymethyl)phenyl]methyl]-3-(4-methylphenyl)propanamide is Cc1ccc(CCC(=O)NCc2cccc(COCc3ccco3)c2)cc1.
What is the InChIKey of N-[[3-(furan-2-ylmethoxymethyl)phenyl]methyl]-3-(4-methylphenyl)propanamide?
The InChIKey is ZDQPJGYVJPJGIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H25NO3/c1-18-7-9-19(10-8-18)11-12-23(25)24-15-20-4-2-5-21(14-20)16-26-17-22-6-3-13-27-22/h2-10,13-14H,11-12,15-17H2,1H3,(H,24,25).
What are the key properties of N-[[3-(furan-2-ylmethoxymethyl)phenyl]methyl]-3-(4-methylphenyl)propanamide?
N-[[3-(furan-2-ylmethoxymethyl)phenyl]methyl]-3-(4-methylphenyl)propanamide has a molecular weight of 363.46 g/mol, XLogP of 4.55, 9 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[3-(furan-2-ylmethoxymethyl)phenyl]methyl]-3-(4-methylphenyl)propanamide is sourced from PubChem (CID 55661006), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).