2-[[2-(1-benzofuran-3-yl)-2-oxoethyl]-ethylamino]-N-ethylacetamide

C16H20N2O3 — CID 62030499

IUPAC2-[[2-(1-benzofuran-3-yl)-2-oxoethyl]-ethylamino]-N-ethylacetamide
SMILESCCNC(=O)CN(CC)CC(=O)c1coc2ccccc12
InChIInChI=1S/C16H20N2O3/c1-3-17-16(20)10-18(4-2)9-14(19)13-11-21-15-8-6-5-7-12(13)15/h5-8,11H,3-4,9-10H2,1-2H3,(H,17,20)
InChIKeyYQNIKZZNWBRXPF-UHFFFAOYSA-N
MW288.35 g/mol
LogP2.07
Rot. Bonds7

About 2-[[2-(1-benzofuran-3-yl)-2-oxoethyl]-ethylamino]-N-ethylacetamide

2-[[2-(1-benzofuran-3-yl)-2-oxoethyl]-ethylamino]-N-ethylacetamide (PubChem CID 62030499) has the molecular formula C16H20N2O3 and a molecular weight of 288.35 g/mol. Its IUPAC name is 2-[[2-(1-benzofuran-3-yl)-2-oxoethyl]-ethylamino]-N-ethylacetamide.

Molecular Properties

Compound Name2-[[2-(1-benzofuran-3-yl)-2-oxoethyl]-ethylamino]-N-ethylacetamide
PubChem CID62030499
Molecular FormulaC16H20N2O3
Molecular Weight288.35 g/mol
Exact Mass288.15
IUPAC Name2-[[2-(1-benzofuran-3-yl)-2-oxoethyl]-ethylamino]-N-ethylacetamide
SMILESCCNC(=O)CN(CC)CC(=O)c1coc2ccccc12
InChIInChI=1S/C16H20N2O3/c1-3-17-16(20)10-18(4-2)9-14(19)13-11-21-15-8-6-5-7-12(13)15/h5-8,11H,3-4,9-10H2,1-2H3,(H,17,20)
InChIKeyYQNIKZZNWBRXPF-UHFFFAOYSA-N
XLogP2.07
TPSA62.55 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.35
LogP ≤ 52.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(1-benzofuran-3-yl)-2-[ethyl(propan-2-yl)amino]ethanone
CID 43795122
1-(1-benzofuran-3-yl)-2-[methyl(propan-2-yl)amino]ethanone
CID 43794594
N-ethyl-2-[ethyl-[2-[(2-methylphenyl)methylamino]-2-oxoethyl]amino]acetamide
CID 40700700
N-ethyl-2-[ethyl-[2-(furan-2-ylmethylamino)-2-oxoethyl]amino]acetamide
CID 26519118
1-(1-benzofuran-3-yl)-2-[2-hydroxyethyl(pentan-3-yl)amino]ethanone
CID 62037335
CID 89242212
CID 89242212
1-(1-benzofuran-3-yl)-2-chloroethanone
CID 77174807
tert-butyl 3-(1-benzofuran-3-yl)-3-oxopropanoate
CID 22925275
2-(1-benzofuran-3-yl)-N-[2-(diethylamino)ethyl]acetamide
CID 110463889
1-(1-benzofuran-3-yl)-2-[cyclopropylmethyl(methyl)amino]ethanone
CID 54884312
N-ethyl-2-[ethyl-(2-oxo-3-phenylpropyl)amino]acetamide
CID 62030498
N-benzyl-2-(diethylamino)acetamide
CID 969777

Frequently Asked Questions

What is the IUPAC name of 2-[[2-(1-benzofuran-3-yl)-2-oxoethyl]-ethylamino]-N-ethylacetamide?
The IUPAC name of 2-[[2-(1-benzofuran-3-yl)-2-oxoethyl]-ethylamino]-N-ethylacetamide (CID 62030499) is 2-[[2-(1-benzofuran-3-yl)-2-oxoethyl]-ethylamino]-N-ethylacetamide.
What is the SMILES notation for 2-[[2-(1-benzofuran-3-yl)-2-oxoethyl]-ethylamino]-N-ethylacetamide?
The canonical SMILES for 2-[[2-(1-benzofuran-3-yl)-2-oxoethyl]-ethylamino]-N-ethylacetamide is CCNC(=O)CN(CC)CC(=O)c1coc2ccccc12.
What is the InChIKey of 2-[[2-(1-benzofuran-3-yl)-2-oxoethyl]-ethylamino]-N-ethylacetamide?
The InChIKey is YQNIKZZNWBRXPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O3/c1-3-17-16(20)10-18(4-2)9-14(19)13-11-21-15-8-6-5-7-12(13)15/h5-8,11H,3-4,9-10H2,1-2H3,(H,17,20).
What are the key properties of 2-[[2-(1-benzofuran-3-yl)-2-oxoethyl]-ethylamino]-N-ethylacetamide?
2-[[2-(1-benzofuran-3-yl)-2-oxoethyl]-ethylamino]-N-ethylacetamide has a molecular weight of 288.35 g/mol, XLogP of 2.07, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2-(1-benzofuran-3-yl)-2-oxoethyl]-ethylamino]-N-ethylacetamide is sourced from PubChem (CID 62030499), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).