N-(1-benzofuran-2-ylmethyl)-N-methyl-2-(3-methylphenoxy)acetamide

C19H19NO3 — CID 110732938

IUPACN-(1-benzofuran-2-ylmethyl)-N-methyl-2-(3-methylphenoxy)acetamide
SMILESCc1cccc(OCC(=O)N(C)Cc2cc3ccccc3o2)c1
InChIInChI=1S/C19H19NO3/c1-14-6-5-8-16(10-14)22-13-19(21)20(2)12-17-11-15-7-3-4-9-18(15)23-17/h3-11H,12-13H2,1-2H3
InChIKeyGUODIHFWYSQQHO-UHFFFAOYSA-N
MW309.37 g/mol
LogP3.78
Rot. Bonds5

About N-(1-benzofuran-2-ylmethyl)-N-methyl-2-(3-methylphenoxy)acetamide

N-(1-benzofuran-2-ylmethyl)-N-methyl-2-(3-methylphenoxy)acetamide (PubChem CID 110732938) has the molecular formula C19H19NO3 and a molecular weight of 309.37 g/mol. Its IUPAC name is N-(1-benzofuran-2-ylmethyl)-N-methyl-2-(3-methylphenoxy)acetamide.

Molecular Properties

Compound NameN-(1-benzofuran-2-ylmethyl)-N-methyl-2-(3-methylphenoxy)acetamide
PubChem CID110732938
Molecular FormulaC19H19NO3
Molecular Weight309.37 g/mol
Exact Mass309.14
IUPAC NameN-(1-benzofuran-2-ylmethyl)-N-methyl-2-(3-methylphenoxy)acetamide
SMILESCc1cccc(OCC(=O)N(C)Cc2cc3ccccc3o2)c1
InChIInChI=1S/C19H19NO3/c1-14-6-5-8-16(10-14)22-13-19(21)20(2)12-17-11-15-7-3-4-9-18(15)23-17/h3-11H,12-13H2,1-2H3
InChIKeyGUODIHFWYSQQHO-UHFFFAOYSA-N
XLogP3.78
TPSA42.68 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.37
LogP ≤ 53.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-(1-benzofuran-2-yl)-2-(3-methylphenoxy)ethanone
CID 43413131
N-(1-benzofuran-2-ylmethyl)-2-(3-methoxyphenyl)-N-methylacetamide
CID 110732936
N-[(2-chlorophenyl)methyl]-N-methyl-2-(3-methylphenoxy)acetamide
CID 112790388
N-(1-benzofuran-2-ylmethyl)-N,3-dimethylbutanamide
CID 110732893
N-(1-benzofuran-2-ylmethyl)-3-(4-methoxyphenyl)-N-methylpropanamide
CID 110732927
ethyl 2-[methyl-[2-(3-methylphenoxy)acetyl]amino]acetate
CID 54785206
4-[methyl-[2-(3-methylphenoxy)acetyl]amino]butanoic acid
CID 43240315
2-(3-aminophenoxy)-N-(furan-2-ylmethyl)-N-methylacetamide
CID 54916005
N-[1-(1-benzofuran-2-yl)ethyl]-2-(3-methoxyphenoxy)-N-methylacetamide
CID 87015123
2-(3-methylphenoxy)-N,N-di(propan-2-yl)acetamide
CID 892170
N-(1-benzofuran-2-ylmethyl)-N-methylpyridine-2-carboxamide
CID 110745356
N-benzhydryl-N-methyl-2-(3-methylphenoxy)acetamide
CID 8919009

Frequently Asked Questions

What is the IUPAC name of N-(1-benzofuran-2-ylmethyl)-N-methyl-2-(3-methylphenoxy)acetamide?
The IUPAC name of N-(1-benzofuran-2-ylmethyl)-N-methyl-2-(3-methylphenoxy)acetamide (CID 110732938) is N-(1-benzofuran-2-ylmethyl)-N-methyl-2-(3-methylphenoxy)acetamide.
What is the SMILES notation for N-(1-benzofuran-2-ylmethyl)-N-methyl-2-(3-methylphenoxy)acetamide?
The canonical SMILES for N-(1-benzofuran-2-ylmethyl)-N-methyl-2-(3-methylphenoxy)acetamide is Cc1cccc(OCC(=O)N(C)Cc2cc3ccccc3o2)c1.
What is the InChIKey of N-(1-benzofuran-2-ylmethyl)-N-methyl-2-(3-methylphenoxy)acetamide?
The InChIKey is GUODIHFWYSQQHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19NO3/c1-14-6-5-8-16(10-14)22-13-19(21)20(2)12-17-11-15-7-3-4-9-18(15)23-17/h3-11H,12-13H2,1-2H3.
What are the key properties of N-(1-benzofuran-2-ylmethyl)-N-methyl-2-(3-methylphenoxy)acetamide?
N-(1-benzofuran-2-ylmethyl)-N-methyl-2-(3-methylphenoxy)acetamide has a molecular weight of 309.37 g/mol, XLogP of 3.78, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-benzofuran-2-ylmethyl)-N-methyl-2-(3-methylphenoxy)acetamide is sourced from PubChem (CID 110732938), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).