N-[(8-methoxybenzo[e][1]benzofuran-2-yl)methyl]acetamide

C16H15NO3 — CID 127026062

IUPACN-[(8-methoxybenzo[e][1]benzofuran-2-yl)methyl]acetamide
SMILESCOc1ccc2ccc3oc(CNC(C)=O)cc3c2c1
InChIInChI=1S/C16H15NO3/c1-10(18)17-9-13-8-15-14-7-12(19-2)5-3-11(14)4-6-16(15)20-13/h3-8H,9H2,1-2H3,(H,17,18)
InChIKeyOLPXPLWYIHZBLK-UHFFFAOYSA-N
MW269.30 g/mol
LogP3.23
Rot. Bonds3

About N-[(8-methoxybenzo[e][1]benzofuran-2-yl)methyl]acetamide

N-[(8-methoxybenzo[e][1]benzofuran-2-yl)methyl]acetamide (PubChem CID 127026062) has the molecular formula C16H15NO3 and a molecular weight of 269.30 g/mol. Its IUPAC name is N-[(8-methoxybenzo[e][1]benzofuran-2-yl)methyl]acetamide.

Molecular Properties

Compound NameN-[(8-methoxybenzo[e][1]benzofuran-2-yl)methyl]acetamide
PubChem CID127026062
Molecular FormulaC16H15NO3
Molecular Weight269.30 g/mol
Exact Mass269.11
IUPAC NameN-[(8-methoxybenzo[e][1]benzofuran-2-yl)methyl]acetamide
SMILESCOc1ccc2ccc3oc(CNC(C)=O)cc3c2c1
InChIInChI=1S/C16H15NO3/c1-10(18)17-9-13-8-15-14-7-12(19-2)5-3-11(14)4-6-16(15)20-13/h3-8H,9H2,1-2H3,(H,17,18)
InChIKeyOLPXPLWYIHZBLK-UHFFFAOYSA-N
XLogP3.23
TPSA51.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.30
LogP ≤ 53.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

S24014
CID 9998187
N-(1-phenylethyl)-1-benzofuran-2-carboxamide
CID 2788390
N-[2-(3,4-dimethoxyphenyl)ethyl]-1-benzofuran-2-carboxamide
CID 725650
N-(2-hydroxyethyl)-3-[2-[[3-(trifluoromethyl)phenyl]methyl]-1-benzofuran-4-yl]benzamide
CID 44623954
N-[2-(5-Methoxy-2-phenyl-benzofuran-3-yl)-ethyl]-acetamide
CID 9839629
N-[2-(7-{4-[3-(2-acetylaminoethyl)benzofuran-5-yloxy]butoxy}naphthalen-1-yl)ethyl]-acetamide
CID 9870683
N-[2-(2-Benzyl-5-methoxy-benzofuran-3-yl)-ethyl]-acrylamide
CID 9884156
N-[2-(2-Benzyl-5-methoxy-benzofuran-3-yl)-ethyl]-acetamide
CID 9927219
But-3-enoic acid [2-(5-methoxy-2-phenyl-benzofuran-3-yl)-ethyl]-amide
CID 10925712
But-3-enoic acid [2-(2-benzyl-5-methoxy-benzofuran-3-yl)-ethyl]-amide
CID 10926138
N-[2-(5-Methoxy-2-phenyl-benzofuran-3-yl)-ethyl]-acrylamide
CID 11723593
N-[2-(2-Benzyl-5-methoxy-benzofuran-3-yl)-ethyl]-butyramide
CID 11810280

Frequently Asked Questions

What is the IUPAC name of N-[(8-methoxybenzo[e][1]benzofuran-2-yl)methyl]acetamide?
The IUPAC name of N-[(8-methoxybenzo[e][1]benzofuran-2-yl)methyl]acetamide (CID 127026062) is N-[(8-methoxybenzo[e][1]benzofuran-2-yl)methyl]acetamide.
What is the SMILES notation for N-[(8-methoxybenzo[e][1]benzofuran-2-yl)methyl]acetamide?
The canonical SMILES for N-[(8-methoxybenzo[e][1]benzofuran-2-yl)methyl]acetamide is COc1ccc2ccc3oc(CNC(C)=O)cc3c2c1.
What is the InChIKey of N-[(8-methoxybenzo[e][1]benzofuran-2-yl)methyl]acetamide?
The InChIKey is OLPXPLWYIHZBLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15NO3/c1-10(18)17-9-13-8-15-14-7-12(19-2)5-3-11(14)4-6-16(15)20-13/h3-8H,9H2,1-2H3,(H,17,18).
What are the key properties of N-[(8-methoxybenzo[e][1]benzofuran-2-yl)methyl]acetamide?
N-[(8-methoxybenzo[e][1]benzofuran-2-yl)methyl]acetamide has a molecular weight of 269.30 g/mol, XLogP of 3.23, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(8-methoxybenzo[e][1]benzofuran-2-yl)methyl]acetamide is sourced from PubChem (CID 127026062), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).