2-(6-ethyl-1-benzofuran-3-yl)-N-propan-2-ylacetamide

C15H19NO2 — CID 18107939

IUPAC2-(6-ethyl-1-benzofuran-3-yl)-N-propan-2-ylacetamide
SMILESCCc1ccc2c(CC(=O)NC(C)C)coc2c1
InChIInChI=1S/C15H19NO2/c1-4-11-5-6-13-12(9-18-14(13)7-11)8-15(17)16-10(2)3/h5-7,9-10H,4,8H2,1-3H3,(H,16,17)
InChIKeyRMHDLDNAXOLKIR-UHFFFAOYSA-N
MW245.32 g/mol
LogP3.06
Rot. Bonds4

About 2-(6-ethyl-1-benzofuran-3-yl)-N-propan-2-ylacetamide

2-(6-ethyl-1-benzofuran-3-yl)-N-propan-2-ylacetamide (PubChem CID 18107939) has the molecular formula C15H19NO2 and a molecular weight of 245.32 g/mol. Its IUPAC name is 2-(6-ethyl-1-benzofuran-3-yl)-N-propan-2-ylacetamide.

Molecular Properties

Compound Name2-(6-ethyl-1-benzofuran-3-yl)-N-propan-2-ylacetamide
PubChem CID18107939
Molecular FormulaC15H19NO2
Molecular Weight245.32 g/mol
Exact Mass245.14
IUPAC Name2-(6-ethyl-1-benzofuran-3-yl)-N-propan-2-ylacetamide
SMILESCCc1ccc2c(CC(=O)NC(C)C)coc2c1
InChIInChI=1S/C15H19NO2/c1-4-11-5-6-13-12(9-18-14(13)7-11)8-15(17)16-10(2)3/h5-7,9-10H,4,8H2,1-3H3,(H,16,17)
InChIKeyRMHDLDNAXOLKIR-UHFFFAOYSA-N
XLogP3.06
TPSA42.24 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.32
LogP ≤ 53.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(6-ethyl-1-benzofuran-3-yl)-N-[(1S)-1-phenylethyl]acetamide
CID 2446439
2-(6-ethyl-1-benzofuran-3-yl)-N-[1-(furan-2-yl)ethyl]acetamide
CID 18110361
2-(6-ethyl-1-benzofuran-3-yl)acetic acid
CID 2393677
N-[(1S)-1-(2,5-dimethoxyphenyl)ethyl]-2-(6-ethyl-1-benzofuran-3-yl)acetamide
CID 9477513
N'-[2-(3,5-dimethylphenoxy)acetyl]-2-(6-ethyl-1-benzofuran-3-yl)acetohydrazide
CID 9470559
N'-[2-(6-ethyl-1-benzofuran-3-yl)acetyl]furan-2-carbohydrazide
CID 18159487
2-(5-methyl-1-benzofuran-3-yl)-N-propan-2-ylacetamide
CID 18872376
2-(6-methoxy-1-benzofuran-3-yl)-N-[2-oxo-2-(propan-2-ylamino)ethyl]acetamide
CID 27742710
2-(6-ethyl-1-benzofuran-3-yl)-N-[4-[methyl(propan-2-yl)sulfamoyl]phenyl]acetamide
CID 9219883
3-chloro-N'-[2-(6-ethyl-1-benzofuran-3-yl)acetyl]benzohydrazide
CID 8913304
2-(6,7-dimethyl-1-benzofuran-3-yl)-N-propan-2-ylacetamide
CID 1285216
[(2S)-1-[(4-fluorophenyl)methylamino]-1-oxopropan-2-yl] 2-(6-ethyl-1-benzofuran-3-yl)acetate
CID 8737699

Frequently Asked Questions

What is the IUPAC name of 2-(6-ethyl-1-benzofuran-3-yl)-N-propan-2-ylacetamide?
The IUPAC name of 2-(6-ethyl-1-benzofuran-3-yl)-N-propan-2-ylacetamide (CID 18107939) is 2-(6-ethyl-1-benzofuran-3-yl)-N-propan-2-ylacetamide.
What is the SMILES notation for 2-(6-ethyl-1-benzofuran-3-yl)-N-propan-2-ylacetamide?
The canonical SMILES for 2-(6-ethyl-1-benzofuran-3-yl)-N-propan-2-ylacetamide is CCc1ccc2c(CC(=O)NC(C)C)coc2c1.
What is the InChIKey of 2-(6-ethyl-1-benzofuran-3-yl)-N-propan-2-ylacetamide?
The InChIKey is RMHDLDNAXOLKIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19NO2/c1-4-11-5-6-13-12(9-18-14(13)7-11)8-15(17)16-10(2)3/h5-7,9-10H,4,8H2,1-3H3,(H,16,17).
What are the key properties of 2-(6-ethyl-1-benzofuran-3-yl)-N-propan-2-ylacetamide?
2-(6-ethyl-1-benzofuran-3-yl)-N-propan-2-ylacetamide has a molecular weight of 245.32 g/mol, XLogP of 3.06, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6-ethyl-1-benzofuran-3-yl)-N-propan-2-ylacetamide is sourced from PubChem (CID 18107939), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).