2-(4,6-dimethyl-1-benzofuran-3-yl)-N-(furan-2-ylmethyl)acetamide

C17H17NO3 — CID 1243461

IUPAC2-(4,6-dimethyl-1-benzofuran-3-yl)-N-(furan-2-ylmethyl)acetamide
SMILESCc1cc(C)c2c(CC(=O)NCc3ccco3)coc2c1
InChIInChI=1S/C17H17NO3/c1-11-6-12(2)17-13(10-21-15(17)7-11)8-16(19)18-9-14-4-3-5-20-14/h3-7,10H,8-9H2,1-2H3,(H,18,19)
InChIKeyLNYUKGHIHVBWDO-UHFFFAOYSA-N
MW283.33 g/mol
LogP3.50
Rot. Bonds4

About 2-(4,6-dimethyl-1-benzofuran-3-yl)-N-(furan-2-ylmethyl)acetamide

2-(4,6-dimethyl-1-benzofuran-3-yl)-N-(furan-2-ylmethyl)acetamide (PubChem CID 1243461) has the molecular formula C17H17NO3 and a molecular weight of 283.33 g/mol. Its IUPAC name is 2-(4,6-dimethyl-1-benzofuran-3-yl)-N-(furan-2-ylmethyl)acetamide.

Molecular Properties

Compound Name2-(4,6-dimethyl-1-benzofuran-3-yl)-N-(furan-2-ylmethyl)acetamide
PubChem CID1243461
Molecular FormulaC17H17NO3
Molecular Weight283.33 g/mol
Exact Mass283.12
IUPAC Name2-(4,6-dimethyl-1-benzofuran-3-yl)-N-(furan-2-ylmethyl)acetamide
SMILESCc1cc(C)c2c(CC(=O)NCc3ccco3)coc2c1
InChIInChI=1S/C17H17NO3/c1-11-6-12(2)17-13(10-21-15(17)7-11)8-16(19)18-9-14-4-3-5-20-14/h3-7,10H,8-9H2,1-2H3,(H,18,19)
InChIKeyLNYUKGHIHVBWDO-UHFFFAOYSA-N
XLogP3.50
TPSA55.38 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.33
LogP ≤ 53.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-fluoro-N-[(8-methoxybenzo[e][1]benzofuran-2-yl)methyl]acetamide
CID 127025784
N-[(8-methoxybenzo[e][1]benzofuran-2-yl)methyl]acetamide
CID 127026062
N-[2-(8-methoxybenzo[e][1]benzofuran-1-yl)ethyl]acetamide
CID 127026423
N-[(8-methoxybenzo[e][1]benzofuran-2-yl)methyl]cyclopropanecarboxamide
CID 127026427
2-(4,6-dimethylbenzo[b]furan-3-yl)-N-(methylethyl)acetamide
CID 1285215
5-methoxy-3-methyl-N-(3-methylbutyl)-2-benzofurancarboxamide
CID 2561213
2-(6-methyl-1-benzofuran-3-yl)-N-(2-methyl-2-morpholin-4-ylpropyl)acetamide
CID 2564980
2-butyl-N-(furan-2-ylmethyl)-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxamide
CID 2667282
N-(2-furylmethyl)-2,2-dimethyl-2,3-dihydro-1-benzofuran-7-carboxamide
CID 2738408
N-(furan-2-ylmethyl)-2-(2-methoxyethyl)-1,3-dioxoisoindole-5-carboxamide
CID 2974655
2-ethyl-N-(2-furylmethyl)-1,3-dioxoisoindoline-5-carboxamide
CID 4367205
7-fluoro-N-(furan-2-ylmethyl)-3-methyl-1-benzofuran-2-carboxamide
CID 8867850

Frequently Asked Questions

What is the IUPAC name of 2-(4,6-dimethyl-1-benzofuran-3-yl)-N-(furan-2-ylmethyl)acetamide?
The IUPAC name of 2-(4,6-dimethyl-1-benzofuran-3-yl)-N-(furan-2-ylmethyl)acetamide (CID 1243461) is 2-(4,6-dimethyl-1-benzofuran-3-yl)-N-(furan-2-ylmethyl)acetamide.
What is the SMILES notation for 2-(4,6-dimethyl-1-benzofuran-3-yl)-N-(furan-2-ylmethyl)acetamide?
The canonical SMILES for 2-(4,6-dimethyl-1-benzofuran-3-yl)-N-(furan-2-ylmethyl)acetamide is Cc1cc(C)c2c(CC(=O)NCc3ccco3)coc2c1.
What is the InChIKey of 2-(4,6-dimethyl-1-benzofuran-3-yl)-N-(furan-2-ylmethyl)acetamide?
The InChIKey is LNYUKGHIHVBWDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17NO3/c1-11-6-12(2)17-13(10-21-15(17)7-11)8-16(19)18-9-14-4-3-5-20-14/h3-7,10H,8-9H2,1-2H3,(H,18,19).
What are the key properties of 2-(4,6-dimethyl-1-benzofuran-3-yl)-N-(furan-2-ylmethyl)acetamide?
2-(4,6-dimethyl-1-benzofuran-3-yl)-N-(furan-2-ylmethyl)acetamide has a molecular weight of 283.33 g/mol, XLogP of 3.50, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4,6-dimethyl-1-benzofuran-3-yl)-N-(furan-2-ylmethyl)acetamide is sourced from PubChem (CID 1243461), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).