N-[(4-ethoxy-3-methoxyphenyl)methyl]-N-methyl-1-benzofuran-2-carboxamide

C20H21NO4 — CID 4780468

IUPACN-[(4-ethoxy-3-methoxyphenyl)methyl]-N-methyl-1-benzofuran-2-carboxamide
SMILESCCOc1ccc(CN(C)C(=O)c2cc3ccccc3o2)cc1OC
InChIInChI=1S/C20H21NO4/c1-4-24-17-10-9-14(11-18(17)23-3)13-21(2)20(22)19-12-15-7-5-6-8-16(15)25-19/h5-12H,4,13H2,1-3H3
InChIKeyWSDUSUHBYJOHCX-UHFFFAOYSA-N
MW339.39 g/mol
LogP4.11
Rot. Bonds6

About N-[(4-ethoxy-3-methoxyphenyl)methyl]-N-methyl-1-benzofuran-2-carboxamide

N-[(4-ethoxy-3-methoxyphenyl)methyl]-N-methyl-1-benzofuran-2-carboxamide (PubChem CID 4780468) has the molecular formula C20H21NO4 and a molecular weight of 339.39 g/mol. Its IUPAC name is N-[(4-ethoxy-3-methoxyphenyl)methyl]-N-methyl-1-benzofuran-2-carboxamide.

Molecular Properties

Compound NameN-[(4-ethoxy-3-methoxyphenyl)methyl]-N-methyl-1-benzofuran-2-carboxamide
PubChem CID4780468
Molecular FormulaC20H21NO4
Molecular Weight339.39 g/mol
Exact Mass339.15
IUPAC NameN-[(4-ethoxy-3-methoxyphenyl)methyl]-N-methyl-1-benzofuran-2-carboxamide
SMILESCCOc1ccc(CN(C)C(=O)c2cc3ccccc3o2)cc1OC
InChIInChI=1S/C20H21NO4/c1-4-24-17-10-9-14(11-18(17)23-3)13-21(2)20(22)19-12-15-7-5-6-8-16(15)25-19/h5-12H,4,13H2,1-3H3
InChIKeyWSDUSUHBYJOHCX-UHFFFAOYSA-N
XLogP4.11
TPSA51.91 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.39
LogP ≤ 54.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze N-[(4-ethoxy-3-methoxyphenyl)methyl]-N-methyl-1-benzofuran-2-carboxamide 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

Abexinostat
CID 11749858
CL82198
CID 2777
Befuraline
CID 68664
Befuraline hydrochloride
CID 73346
4-((3-Methyl-1-benzofuran-2-YL)carbonyl)morpholine
CID 768761
N-(1-phenylethyl)-1-benzofuran-2-carboxamide
CID 2788390
N-[2-(3,4-dimethoxyphenyl)ethyl]-1-benzofuran-2-carboxamide
CID 725650
1-(1-Benzofuran-2-ylcarbonyl)-4-methylpiperidine
CID 977492
[5-(4-Propyl-phenoxymethyl)-furan-2-yl]-pyrrolidin-1-yl-methanone
CID 1091762
5-[(2-methoxy-4-propylphenoxy)methyl]-N-propyl-2-furamide
CID 2166253
5-[(2-methoxyphenoxy)methyl]-N-(1-phenylethyl)-2-furamide
CID 2942268
Benzofuran-2-yl(pyrrolidin-1-yl)methanone
CID 977385

Frequently Asked Questions

What is the IUPAC name of N-[(4-ethoxy-3-methoxyphenyl)methyl]-N-methyl-1-benzofuran-2-carboxamide?
The IUPAC name of N-[(4-ethoxy-3-methoxyphenyl)methyl]-N-methyl-1-benzofuran-2-carboxamide (CID 4780468) is N-[(4-ethoxy-3-methoxyphenyl)methyl]-N-methyl-1-benzofuran-2-carboxamide.
What is the SMILES notation for N-[(4-ethoxy-3-methoxyphenyl)methyl]-N-methyl-1-benzofuran-2-carboxamide?
The canonical SMILES for N-[(4-ethoxy-3-methoxyphenyl)methyl]-N-methyl-1-benzofuran-2-carboxamide is CCOc1ccc(CN(C)C(=O)c2cc3ccccc3o2)cc1OC.
What is the InChIKey of N-[(4-ethoxy-3-methoxyphenyl)methyl]-N-methyl-1-benzofuran-2-carboxamide?
The InChIKey is WSDUSUHBYJOHCX-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H21NO4/c1-4-24-17-10-9-14(11-18(17)23-3)13-21(2)20(22)19-12-15-7-5-6-8-16(15)25-19/h5-12H,4,13H2,1-3H3.
What are the key properties of N-[(4-ethoxy-3-methoxyphenyl)methyl]-N-methyl-1-benzofuran-2-carboxamide?
N-[(4-ethoxy-3-methoxyphenyl)methyl]-N-methyl-1-benzofuran-2-carboxamide has a molecular weight of 339.39 g/mol, XLogP of 4.11, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-ethoxy-3-methoxyphenyl)methyl]-N-methyl-1-benzofuran-2-carboxamide is sourced from PubChem (CID 4780468), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).