2-(diethylamino)-1-(2,3-dihydrofuran-5-yl)-2-methylpropan-1-one

C12H21NO2 — CID 102651005

IUPAC2-(diethylamino)-1-(2,3-dihydrofuran-5-yl)-2-methylpropan-1-one
SMILESCCN(CC)C(C)(C)C(=O)C1=CCCO1
InChIInChI=1S/C12H21NO2/c1-5-13(6-2)12(3,4)11(14)10-8-7-9-15-10/h8H,5-7,9H2,1-4H3
InChIKeyDXPIQRVCBFCDDH-UHFFFAOYSA-N
MW211.30 g/mol
LogP1.98
Rot. Bonds5

About 2-(diethylamino)-1-(2,3-dihydrofuran-5-yl)-2-methylpropan-1-one

2-(diethylamino)-1-(2,3-dihydrofuran-5-yl)-2-methylpropan-1-one (PubChem CID 102651005) has the molecular formula C12H21NO2 and a molecular weight of 211.30 g/mol. Its IUPAC name is 2-(diethylamino)-1-(2,3-dihydrofuran-5-yl)-2-methylpropan-1-one.

Molecular Properties

Compound Name2-(diethylamino)-1-(2,3-dihydrofuran-5-yl)-2-methylpropan-1-one
PubChem CID102651005
Molecular FormulaC12H21NO2
Molecular Weight211.30 g/mol
Exact Mass211.16
IUPAC Name2-(diethylamino)-1-(2,3-dihydrofuran-5-yl)-2-methylpropan-1-one
SMILESCCN(CC)C(C)(C)C(=O)C1=CCCO1
InChIInChI=1S/C12H21NO2/c1-5-13(6-2)12(3,4)11(14)10-8-7-9-15-10/h8H,5-7,9H2,1-4H3
InChIKeyDXPIQRVCBFCDDH-UHFFFAOYSA-N
XLogP1.98
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.30
LogP ≤ 51.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 2-(diethylamino)-1-(2,3-dihydrofuran-5-yl)-2-methylpropan-1-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(3,4-dihydro-2H-pyran-6-yl)-2-(dimethylamino)-2-methylpropan-1-one
CID 102646932
2-(diethylamino)-1-(3,4-dihydro-2H-pyran-6-yl)-2-methylpropan-1-one
CID 102646933
1-(3,4-dihydro-2H-pyran-6-yl)-2-methyl-2-pyrrolidin-1-ylpropan-1-one
CID 102646934
1-(3,4-dihydro-2H-pyran-6-yl)-2-methyl-2-piperidin-1-ylpropan-1-one
CID 102646935
1-(3,4-dihydro-2H-pyran-6-yl)-2-methyl-2-morpholin-4-ylpropan-1-one
CID 102646936
1-(3,4-dihydro-2H-pyran-6-yl)-2-(dimethylamino)-2-methylbutan-1-one
CID 102646937
2-(diethylamino)-1-(3,4-dihydro-2H-pyran-6-yl)-2-methylbutan-1-one
CID 102646938
1-(3,4-dihydro-2H-pyran-6-yl)-2-methyl-2-pyrrolidin-1-ylbutan-1-one
CID 102646939
1-(3,4-dihydro-2H-pyran-6-yl)-2-(dimethylamino)-2-ethylbutan-1-one
CID 102646941
2-(diethylamino)-1-(3,4-dihydro-2H-pyran-6-yl)-2-ethylbutan-1-one
CID 102646942
1-(3,4-dihydro-2H-pyran-6-yl)-2-ethyl-2-pyrrolidin-1-ylbutan-1-one
CID 102646943
1-(3,4-dihydro-2H-pyran-6-yl)-2-(ethylamino)-2-methylpropan-1-one
CID 102648335

Frequently Asked Questions

What is the IUPAC name of 2-(diethylamino)-1-(2,3-dihydrofuran-5-yl)-2-methylpropan-1-one?
The IUPAC name of 2-(diethylamino)-1-(2,3-dihydrofuran-5-yl)-2-methylpropan-1-one (CID 102651005) is 2-(diethylamino)-1-(2,3-dihydrofuran-5-yl)-2-methylpropan-1-one.
What is the SMILES notation for 2-(diethylamino)-1-(2,3-dihydrofuran-5-yl)-2-methylpropan-1-one?
The canonical SMILES for 2-(diethylamino)-1-(2,3-dihydrofuran-5-yl)-2-methylpropan-1-one is CCN(CC)C(C)(C)C(=O)C1=CCCO1.
What is the InChIKey of 2-(diethylamino)-1-(2,3-dihydrofuran-5-yl)-2-methylpropan-1-one?
The InChIKey is DXPIQRVCBFCDDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21NO2/c1-5-13(6-2)12(3,4)11(14)10-8-7-9-15-10/h8H,5-7,9H2,1-4H3.
What are the key properties of 2-(diethylamino)-1-(2,3-dihydrofuran-5-yl)-2-methylpropan-1-one?
2-(diethylamino)-1-(2,3-dihydrofuran-5-yl)-2-methylpropan-1-one has a molecular weight of 211.30 g/mol, XLogP of 1.98, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(diethylamino)-1-(2,3-dihydrofuran-5-yl)-2-methylpropan-1-one is sourced from PubChem (CID 102651005), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).