4-butoxy-N-[furan-2-yl(phenyl)methyl]-3-methoxybenzamide

C23H25NO4 — CID 134029325

IUPAC4-butoxy-N-[furan-2-yl(phenyl)methyl]-3-methoxybenzamide
SMILESCCCCOc1ccc(C(=O)NC(c2ccccc2)c2ccco2)cc1OC
InChIInChI=1S/C23H25NO4/c1-3-4-14-27-19-13-12-18(16-21(19)26-2)23(25)24-22(20-11-8-15-28-20)17-9-6-5-7-10-17/h5-13,15-16,22H,3-4,14H2,1-2H3,(H,24,25)
InChIKeyZNWAHNFIZWNZNN-UHFFFAOYSA-N
MW379.46 g/mol
LogP4.99
Rot. Bonds9

About 4-butoxy-N-[furan-2-yl(phenyl)methyl]-3-methoxybenzamide

4-butoxy-N-[furan-2-yl(phenyl)methyl]-3-methoxybenzamide (PubChem CID 134029325) has the molecular formula C23H25NO4 and a molecular weight of 379.46 g/mol. Its IUPAC name is 4-butoxy-N-[furan-2-yl(phenyl)methyl]-3-methoxybenzamide.

Molecular Properties

Compound Name4-butoxy-N-[furan-2-yl(phenyl)methyl]-3-methoxybenzamide
PubChem CID134029325
Molecular FormulaC23H25NO4
Molecular Weight379.46 g/mol
Exact Mass379.18
IUPAC Name4-butoxy-N-[furan-2-yl(phenyl)methyl]-3-methoxybenzamide
SMILESCCCCOc1ccc(C(=O)NC(c2ccccc2)c2ccco2)cc1OC
InChIInChI=1S/C23H25NO4/c1-3-4-14-27-19-13-12-18(16-21(19)26-2)23(25)24-22(20-11-8-15-28-20)17-9-6-5-7-10-17/h5-13,15-16,22H,3-4,14H2,1-2H3,(H,24,25)
InChIKeyZNWAHNFIZWNZNN-UHFFFAOYSA-N
XLogP4.99
TPSA60.70 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500379.46
LogP ≤ 54.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 4-butoxy-N-[furan-2-yl(phenyl)methyl]-3-methoxybenzamide with MolForge

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

Launch Full Analysis

Related Compounds

4-(4-acetyl-2-methoxyphenoxy)-N-[furan-2-yl(phenyl)methyl]butanamide
CID 55759778
N-[furan-2-yl(phenyl)methyl]-2,5-dimethoxybenzamide
CID 51217853
3,4,5-triethoxy-N-[(S)-furan-2-yl(phenyl)methyl]benzamide
CID 8928137
4-butoxy-3-methoxy-N-[(2S)-2-phenylpropyl]benzamide
CID 9302117
N'-benzoyl-4-butoxy-3-methoxybenzohydrazide
CID 9440054
N-[(1R)-1-(furan-2-yl)ethyl]-3-methoxy-4-phenylmethoxybenzamide
CID 9481817
N-[(2S)-1-[2-(4-butoxy-3-methoxybenzoyl)hydrazinyl]-1-oxopropan-2-yl]furan-2-carboxamide
CID 24553444
4-butoxy-N-(1-hydroxypropan-2-yl)-3-methoxybenzamide
CID 78856853
N-[(R)-furan-2-yl(phenyl)methyl]-3,5-dimethylbenzamide
CID 8928204
3,4-dimethoxy-N-[1-(3-methoxy-4-pentoxyphenyl)ethyl]benzamide
CID 55747285
4-butoxy-3-methoxy-N-[1-oxo-1-(propylamino)propan-2-yl]benzamide
CID 46655429
N-[furan-2-yl(phenyl)methyl]-2-(2-methoxyphenyl)acetamide
CID 51217838

Frequently Asked Questions

What is the IUPAC name of 4-butoxy-N-[furan-2-yl(phenyl)methyl]-3-methoxybenzamide?
The IUPAC name of 4-butoxy-N-[furan-2-yl(phenyl)methyl]-3-methoxybenzamide (CID 134029325) is 4-butoxy-N-[furan-2-yl(phenyl)methyl]-3-methoxybenzamide.
What is the SMILES notation for 4-butoxy-N-[furan-2-yl(phenyl)methyl]-3-methoxybenzamide?
The canonical SMILES for 4-butoxy-N-[furan-2-yl(phenyl)methyl]-3-methoxybenzamide is CCCCOc1ccc(C(=O)NC(c2ccccc2)c2ccco2)cc1OC.
What is the InChIKey of 4-butoxy-N-[furan-2-yl(phenyl)methyl]-3-methoxybenzamide?
The InChIKey is ZNWAHNFIZWNZNN-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H25NO4/c1-3-4-14-27-19-13-12-18(16-21(19)26-2)23(25)24-22(20-11-8-15-28-20)17-9-6-5-7-10-17/h5-13,15-16,22H,3-4,14H2,1-2H3,(H,24,25).
What are the key properties of 4-butoxy-N-[furan-2-yl(phenyl)methyl]-3-methoxybenzamide?
4-butoxy-N-[furan-2-yl(phenyl)methyl]-3-methoxybenzamide has a molecular weight of 379.46 g/mol, XLogP of 4.99, 9 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-butoxy-N-[furan-2-yl(phenyl)methyl]-3-methoxybenzamide is sourced from PubChem (CID 134029325), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).