N,N-diethyl-2-(5-methyl-1-benzofuran-3-yl)acetamide

C15H19NO2 — CID 110488649

IUPACN,N-diethyl-2-(5-methyl-1-benzofuran-3-yl)acetamide
SMILESCCN(CC)C(=O)Cc1coc2ccc(C)cc12
InChIInChI=1S/C15H19NO2/c1-4-16(5-2)15(17)9-12-10-18-14-7-6-11(3)8-13(12)14/h6-8,10H,4-5,9H2,1-3H3
InChIKeyUDRCQIIIJMRNAF-UHFFFAOYSA-N
MW245.32 g/mol
LogP3.15
Rot. Bonds4

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

N,N-diethyl-2-(5-methyl-1-benzofuran-3-yl)acetamide (PubChem CID 110488649) has the molecular formula C15H19NO2 and a molecular weight of 245.32 g/mol. Its IUPAC name is N,N-diethyl-2-(5-methyl-1-benzofuran-3-yl)acetamide.

Molecular Properties

Compound NameN,N-diethyl-2-(5-methyl-1-benzofuran-3-yl)acetamide
PubChem CID110488649
Molecular FormulaC15H19NO2
Molecular Weight245.32 g/mol
Exact Mass245.14
IUPAC NameN,N-diethyl-2-(5-methyl-1-benzofuran-3-yl)acetamide
SMILESCCN(CC)C(=O)Cc1coc2ccc(C)cc12
InChIInChI=1S/C15H19NO2/c1-4-16(5-2)15(17)9-12-10-18-14-7-6-11(3)8-13(12)14/h6-8,10H,4-5,9H2,1-3H3
InChIKeyUDRCQIIIJMRNAF-UHFFFAOYSA-N
XLogP3.15
TPSA33.45 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.32
LogP ≤ 53.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

(4-methylphenyl) 2-(5-methyl-1-benzofuran-3-yl)acetate
CID 18872439
N-methyl-2-(5-methyl-1-benzofuran-3-yl)-N-(1-methylpiperidin-4-yl)acetamide
CID 18872342
2-(5-methyl-1-benzofuran-3-yl)-N-propan-2-ylacetamide
CID 18872376
N'-[2-(5-methyl-1-benzofuran-3-yl)acetyl]-2-phenylacetohydrazide
CID 18872421
2-(5-methyl-1-benzofuran-3-yl)-N-phenylacetamide
CID 18860446
N-[[4-(dimethylamino)phenyl]methyl]-N-(furan-2-ylmethyl)-2-(5-methyl-1-benzofuran-3-yl)acetamide
CID 2975752
N'-hydroxy-2-(5-methyl-1-benzofuran-3-yl)ethanimidamide
CID 119085603
(4-chlorophenyl) 2-(5-methyl-1-benzofuran-3-yl)acetate
CID 18860472
N-benzyl-N-[(6-methyl-4-oxochromen-3-yl)methyl]butanamide
CID 42785941
2-(5-methyl-1-benzofuran-3-yl)-N-(2-phenylethyl)acetamide
CID 18872386
2-(5-methyl-1-benzofuran-3-yl)-N'-(2-phenoxyacetyl)acetohydrazide
CID 18872422
3-(6-methyl-4-oxochromen-3-yl)propanoic acid
CID 16643139

Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-2-(5-methyl-1-benzofuran-3-yl)acetamide?
The IUPAC name of N,N-diethyl-2-(5-methyl-1-benzofuran-3-yl)acetamide (CID 110488649) is N,N-diethyl-2-(5-methyl-1-benzofuran-3-yl)acetamide.
What is the SMILES notation for N,N-diethyl-2-(5-methyl-1-benzofuran-3-yl)acetamide?
The canonical SMILES for N,N-diethyl-2-(5-methyl-1-benzofuran-3-yl)acetamide is CCN(CC)C(=O)Cc1coc2ccc(C)cc12.
What is the InChIKey of N,N-diethyl-2-(5-methyl-1-benzofuran-3-yl)acetamide?
The InChIKey is UDRCQIIIJMRNAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19NO2/c1-4-16(5-2)15(17)9-12-10-18-14-7-6-11(3)8-13(12)14/h6-8,10H,4-5,9H2,1-3H3.
What are the key properties of N,N-diethyl-2-(5-methyl-1-benzofuran-3-yl)acetamide?
N,N-diethyl-2-(5-methyl-1-benzofuran-3-yl)acetamide has a molecular weight of 245.32 g/mol, XLogP of 3.15, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-2-(5-methyl-1-benzofuran-3-yl)acetamide is sourced from PubChem (CID 110488649), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).