1-(2,3-dihydrofuran-5-yl)-2-(dimethylamino)ethanone

C8H13NO2 — CID 102651028

IUPAC1-(2,3-dihydrofuran-5-yl)-2-(dimethylamino)ethanone
SMILESCN(C)CC(=O)C1=CCCO1
InChIInChI=1S/C8H13NO2/c1-9(2)6-7(10)8-4-3-5-11-8/h4H,3,5-6H2,1-2H3
InChIKeyBHEKWDGDYVDUPY-UHFFFAOYSA-N
MW155.20 g/mol
LogP0.42
Rot. Bonds3

About 1-(2,3-dihydrofuran-5-yl)-2-(dimethylamino)ethanone

1-(2,3-dihydrofuran-5-yl)-2-(dimethylamino)ethanone (PubChem CID 102651028) has the molecular formula C8H13NO2 and a molecular weight of 155.20 g/mol. Its IUPAC name is 1-(2,3-dihydrofuran-5-yl)-2-(dimethylamino)ethanone.

Molecular Properties

Compound Name1-(2,3-dihydrofuran-5-yl)-2-(dimethylamino)ethanone
PubChem CID102651028
Molecular FormulaC8H13NO2
Molecular Weight155.20 g/mol
Exact Mass155.09
IUPAC Name1-(2,3-dihydrofuran-5-yl)-2-(dimethylamino)ethanone
SMILESCN(C)CC(=O)C1=CCCO1
InChIInChI=1S/C8H13NO2/c1-9(2)6-7(10)8-4-3-5-11-8/h4H,3,5-6H2,1-2H3
InChIKeyBHEKWDGDYVDUPY-UHFFFAOYSA-N
XLogP0.42
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.20
LogP ≤ 50.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

3-[3-(Dimethylamino)propoxy]-2-methylpyran-4-one
CID 82064670
1-(4,5-Dihydrofuran-2-yl)-2-(methylamino)ethan-1-one
CID 84020687
1-(3,4-dihydro-2H-pyran-6-yl)-2-(dimethylamino)ethanone
CID 102646952
1-(2,3-Dihydrofuran-5-yl)-2-(dimethylamino)-2-methylpropan-1-one
CID 102651004
2-(Diethylamino)-1-(2,3-dihydrofuran-5-yl)-2-methylpropan-1-one
CID 102651005
1-(2,3-Dihydrofuran-5-yl)-2-(propan-2-ylamino)ethanone
CID 102652417
1-(4,5-Dihydrofuran-2-yl)-2-(ethylamino)ethan-1-one
CID 102652446
1-(2,3-Dihydrofuran-5-yl)-2-(propylamino)ethanone
CID 102652447

Frequently Asked Questions

What is the IUPAC name of 1-(2,3-dihydrofuran-5-yl)-2-(dimethylamino)ethanone?
The IUPAC name of 1-(2,3-dihydrofuran-5-yl)-2-(dimethylamino)ethanone (CID 102651028) is 1-(2,3-dihydrofuran-5-yl)-2-(dimethylamino)ethanone.
What is the SMILES notation for 1-(2,3-dihydrofuran-5-yl)-2-(dimethylamino)ethanone?
The canonical SMILES for 1-(2,3-dihydrofuran-5-yl)-2-(dimethylamino)ethanone is CN(C)CC(=O)C1=CCCO1.
What is the InChIKey of 1-(2,3-dihydrofuran-5-yl)-2-(dimethylamino)ethanone?
The InChIKey is BHEKWDGDYVDUPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13NO2/c1-9(2)6-7(10)8-4-3-5-11-8/h4H,3,5-6H2,1-2H3.
What are the key properties of 1-(2,3-dihydrofuran-5-yl)-2-(dimethylamino)ethanone?
1-(2,3-dihydrofuran-5-yl)-2-(dimethylamino)ethanone has a molecular weight of 155.20 g/mol, XLogP of 0.42, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,3-dihydrofuran-5-yl)-2-(dimethylamino)ethanone is sourced from PubChem (CID 102651028), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).