2-(3-methyl-1-benzofuran-5-yl)acetamide

C11H11NO2 — CID 20824542

IUPAC2-(3-methyl-1-benzofuran-5-yl)acetamide
SMILESCc1coc2ccc(CC(N)=O)cc12
InChIInChI=1S/C11H11NO2/c1-7-6-14-10-3-2-8(4-9(7)10)5-11(12)13/h2-4,6H,5H2,1H3,(H2,12,13)
InChIKeyNEHWDZUBQACCBV-UHFFFAOYSA-N
MW189.21 g/mol
LogP1.77
Rot. Bonds2

About 2-(3-methyl-1-benzofuran-5-yl)acetamide

2-(3-methyl-1-benzofuran-5-yl)acetamide (PubChem CID 20824542) has the molecular formula C11H11NO2 and a molecular weight of 189.21 g/mol. Its IUPAC name is 2-(3-methyl-1-benzofuran-5-yl)acetamide.

Molecular Properties

Compound Name2-(3-methyl-1-benzofuran-5-yl)acetamide
PubChem CID20824542
Molecular FormulaC11H11NO2
Molecular Weight189.21 g/mol
Exact Mass189.08
IUPAC Name2-(3-methyl-1-benzofuran-5-yl)acetamide
SMILESCc1coc2ccc(CC(N)=O)cc12
InChIInChI=1S/C11H11NO2/c1-7-6-14-10-3-2-8(4-9(7)10)5-11(12)13/h2-4,6H,5H2,1H3,(H2,12,13)
InChIKeyNEHWDZUBQACCBV-UHFFFAOYSA-N
XLogP1.77
TPSA56.23 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.21
LogP ≤ 51.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(3-methyl-1-benzofuran-5-yl)acetamide?
The IUPAC name of 2-(3-methyl-1-benzofuran-5-yl)acetamide (CID 20824542) is 2-(3-methyl-1-benzofuran-5-yl)acetamide.
What is the SMILES notation for 2-(3-methyl-1-benzofuran-5-yl)acetamide?
The canonical SMILES for 2-(3-methyl-1-benzofuran-5-yl)acetamide is Cc1coc2ccc(CC(N)=O)cc12.
What is the InChIKey of 2-(3-methyl-1-benzofuran-5-yl)acetamide?
The InChIKey is NEHWDZUBQACCBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11NO2/c1-7-6-14-10-3-2-8(4-9(7)10)5-11(12)13/h2-4,6H,5H2,1H3,(H2,12,13).
What are the key properties of 2-(3-methyl-1-benzofuran-5-yl)acetamide?
2-(3-methyl-1-benzofuran-5-yl)acetamide has a molecular weight of 189.21 g/mol, XLogP of 1.77, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methyl-1-benzofuran-5-yl)acetamide is sourced from PubChem (CID 20824542), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).