2-methyl-N-[(5-phenoxy-2,3-dihydro-1-benzofuran-2-yl)methyl]benzamide

C23H21NO3 — CID 46090158

IUPAC2-methyl-N-[(5-phenoxy-2,3-dihydro-1-benzofuran-2-yl)methyl]benzamide
SMILESCc1ccccc1C(=O)NCC1Cc2cc(Oc3ccccc3)ccc2O1
InChIInChI=1S/C23H21NO3/c1-16-7-5-6-10-21(16)23(25)24-15-20-14-17-13-19(11-12-22(17)27-20)26-18-8-3-2-4-9-18/h2-13,20H,14-15H2,1H3,(H,24,25)
InChIKeyAILJYDQAHOOMJE-UHFFFAOYSA-N
MW359.43 g/mol
LogP4.52
Rot. Bonds5

About 2-methyl-N-[(5-phenoxy-2,3-dihydro-1-benzofuran-2-yl)methyl]benzamide

2-methyl-N-[(5-phenoxy-2,3-dihydro-1-benzofuran-2-yl)methyl]benzamide (PubChem CID 46090158) has the molecular formula C23H21NO3 and a molecular weight of 359.43 g/mol. Its IUPAC name is 2-methyl-N-[(5-phenoxy-2,3-dihydro-1-benzofuran-2-yl)methyl]benzamide.

Molecular Properties

Compound Name2-methyl-N-[(5-phenoxy-2,3-dihydro-1-benzofuran-2-yl)methyl]benzamide
PubChem CID46090158
Molecular FormulaC23H21NO3
Molecular Weight359.43 g/mol
Exact Mass359.15
IUPAC Name2-methyl-N-[(5-phenoxy-2,3-dihydro-1-benzofuran-2-yl)methyl]benzamide
SMILESCc1ccccc1C(=O)NCC1Cc2cc(Oc3ccccc3)ccc2O1
InChIInChI=1S/C23H21NO3/c1-16-7-5-6-10-21(16)23(25)24-15-20-14-17-13-19(11-12-22(17)27-20)26-18-8-3-2-4-9-18/h2-13,20H,14-15H2,1H3,(H,24,25)
InChIKeyAILJYDQAHOOMJE-UHFFFAOYSA-N
XLogP4.52
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.43
LogP ≤ 54.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-methyl-N-[(5-phenoxy-2,3-dihydro-1-benzofuran-2-yl)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

Related Compounds

N-[[(2S)-5-fluoro-2,3-dihydro-1-benzofuran-2-yl]methyl]-2-methylbenzamide
CID 92756956
4-fluoro-N-[(5-phenoxy-2,3-dihydro-1-benzofuran-2-yl)methyl]benzamide
CID 46082466
N-[(5-tert-butyl-2,3-dihydro-1-benzofuran-2-yl)methyl]-2-methylbenzamide
CID 46090223
3,4-dimethoxy-N-[[(2R)-5-phenoxy-2,3-dihydro-1-benzofuran-2-yl]methyl]benzamide
CID 92767700
N-[[(2S)-5-phenoxy-2,3-dihydro-1-benzofuran-2-yl]methyl]prop-2-enamide
CID 92757118
2-phenoxy-N-[[(2R)-5-phenoxy-2,3-dihydro-1-benzofuran-2-yl]methyl]acetamide
CID 92761558
(2R)-2-ethyl-N-[[(2S)-5-phenoxy-2,3-dihydro-1-benzofuran-2-yl]methyl]hexanamide
CID 92758001
2-ethyl-N-[(5-phenoxy-2,3-dihydro-1-benzofuran-2-yl)methyl]hexanamide
CID 46090185
N-[(5-methoxy-2,3-dihydro-1-benzofuran-2-yl)methyl]-2,5-dimethylfuran-3-carboxamide
CID 46704833
N-[[(2R)-5-methoxy-2,3-dihydro-1-benzofuran-2-yl]methyl]naphthalene-2-carboxamide
CID 92760795
N-[[(2S)-5-methoxy-2,3-dihydro-1-benzofuran-2-yl]methyl]-2-phenoxyacetamide
CID 92757032
N-(2,3-dihydro-1-benzofuran-2-ylmethyl)-2-fluoro-3-methylbenzamide
CID 80710892

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[(5-phenoxy-2,3-dihydro-1-benzofuran-2-yl)methyl]benzamide?
The IUPAC name of 2-methyl-N-[(5-phenoxy-2,3-dihydro-1-benzofuran-2-yl)methyl]benzamide (CID 46090158) is 2-methyl-N-[(5-phenoxy-2,3-dihydro-1-benzofuran-2-yl)methyl]benzamide.
What is the SMILES notation for 2-methyl-N-[(5-phenoxy-2,3-dihydro-1-benzofuran-2-yl)methyl]benzamide?
The canonical SMILES for 2-methyl-N-[(5-phenoxy-2,3-dihydro-1-benzofuran-2-yl)methyl]benzamide is Cc1ccccc1C(=O)NCC1Cc2cc(Oc3ccccc3)ccc2O1.
What is the InChIKey of 2-methyl-N-[(5-phenoxy-2,3-dihydro-1-benzofuran-2-yl)methyl]benzamide?
The InChIKey is AILJYDQAHOOMJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H21NO3/c1-16-7-5-6-10-21(16)23(25)24-15-20-14-17-13-19(11-12-22(17)27-20)26-18-8-3-2-4-9-18/h2-13,20H,14-15H2,1H3,(H,24,25).
What are the key properties of 2-methyl-N-[(5-phenoxy-2,3-dihydro-1-benzofuran-2-yl)methyl]benzamide?
2-methyl-N-[(5-phenoxy-2,3-dihydro-1-benzofuran-2-yl)methyl]benzamide has a molecular weight of 359.43 g/mol, XLogP of 4.52, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[(5-phenoxy-2,3-dihydro-1-benzofuran-2-yl)methyl]benzamide is sourced from PubChem (CID 46090158), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).