1-benzofuran-2-yl-[4-(ethylamino)oxolan-3-yl]methanone

C15H17NO3 — CID 114736917

IUPAC1-benzofuran-2-yl-[4-(ethylamino)oxolan-3-yl]methanone
SMILESCCNC1COCC1C(=O)c1cc2ccccc2o1
InChIInChI=1S/C15H17NO3/c1-2-16-12-9-18-8-11(12)15(17)14-7-10-5-3-4-6-13(10)19-14/h3-7,11-12,16H,2,8-9H2,1H3
InChIKeyJMWULZWXGVYFNG-UHFFFAOYSA-N
MW259.30 g/mol
LogP2.24
Rot. Bonds4

About 1-benzofuran-2-yl-[4-(ethylamino)oxolan-3-yl]methanone

1-benzofuran-2-yl-[4-(ethylamino)oxolan-3-yl]methanone (PubChem CID 114736917) has the molecular formula C15H17NO3 and a molecular weight of 259.30 g/mol. Its IUPAC name is 1-benzofuran-2-yl-[4-(ethylamino)oxolan-3-yl]methanone.

Molecular Properties

Compound Name1-benzofuran-2-yl-[4-(ethylamino)oxolan-3-yl]methanone
PubChem CID114736917
Molecular FormulaC15H17NO3
Molecular Weight259.30 g/mol
Exact Mass259.12
IUPAC Name1-benzofuran-2-yl-[4-(ethylamino)oxolan-3-yl]methanone
SMILESCCNC1COCC1C(=O)c1cc2ccccc2o1
InChIInChI=1S/C15H17NO3/c1-2-16-12-9-18-8-11(12)15(17)14-7-10-5-3-4-6-13(10)19-14/h3-7,11-12,16H,2,8-9H2,1H3
InChIKeyJMWULZWXGVYFNG-UHFFFAOYSA-N
XLogP2.24
TPSA51.47 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.30
LogP ≤ 52.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[4-(ethylamino)oxolan-3-yl]-phenylmethanone
CID 116588048
(5-chloro-1-benzofuran-2-yl)-[4-(propylamino)oxolan-3-yl]methanone
CID 114736916
1-benzofuran-2-yl-(2-methylcyclopentyl)methanone
CID 107187534
1-benzofuran-2-yl-(4-ethylcyclohexyl)methanone
CID 64773771
(3-ethoxyphenyl)-[4-(ethylamino)oxolan-3-yl]methanone
CID 116588175
3-phenylpropyl 4-(ethylamino)oxolane-3-carboxylate
CID 66247348
(2S)-1-(1-benzofuran-2-yl)-2-(ethylamino)propan-1-one
CID 171632707
N-(2-chlorophenyl)-4-(ethylamino)oxolane-3-carboxamide
CID 66259041
1-(1-benzofuran-2-yl)pentane-1,3-dione
CID 28896262
4-(ethylamino)-N-[(2-methylphenyl)methyl]oxolane-3-carboxamide
CID 66258098
1-(1-benzofuran-2-yl)ethanone
CID 15435
1-benzofuran-2-yl(piperidin-4-yl)methanone
CID 82275112

Frequently Asked Questions

What is the IUPAC name of 1-benzofuran-2-yl-[4-(ethylamino)oxolan-3-yl]methanone?
The IUPAC name of 1-benzofuran-2-yl-[4-(ethylamino)oxolan-3-yl]methanone (CID 114736917) is 1-benzofuran-2-yl-[4-(ethylamino)oxolan-3-yl]methanone.
What is the SMILES notation for 1-benzofuran-2-yl-[4-(ethylamino)oxolan-3-yl]methanone?
The canonical SMILES for 1-benzofuran-2-yl-[4-(ethylamino)oxolan-3-yl]methanone is CCNC1COCC1C(=O)c1cc2ccccc2o1.
What is the InChIKey of 1-benzofuran-2-yl-[4-(ethylamino)oxolan-3-yl]methanone?
The InChIKey is JMWULZWXGVYFNG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17NO3/c1-2-16-12-9-18-8-11(12)15(17)14-7-10-5-3-4-6-13(10)19-14/h3-7,11-12,16H,2,8-9H2,1H3.
What are the key properties of 1-benzofuran-2-yl-[4-(ethylamino)oxolan-3-yl]methanone?
1-benzofuran-2-yl-[4-(ethylamino)oxolan-3-yl]methanone has a molecular weight of 259.30 g/mol, XLogP of 2.24, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-benzofuran-2-yl-[4-(ethylamino)oxolan-3-yl]methanone is sourced from PubChem (CID 114736917), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).