2,3-dihydrofuran-5-yl-(1,4-dimethylpiperazin-2-yl)methanone

C11H18N2O2 — CID 102651036

IUPAC2,3-dihydrofuran-5-yl-(1,4-dimethylpiperazin-2-yl)methanone
SMILESCN1CCN(C)C(C(=O)C2=CCCO2)C1
InChIInChI=1S/C11H18N2O2/c1-12-5-6-13(2)9(8-12)11(14)10-4-3-7-15-10/h4,9H,3,5-8H2,1-2H3
InChIKeyHBDJUWAALWYCQC-UHFFFAOYSA-N
MW210.28 g/mol
LogP0.11
Rot. Bonds2

About 2,3-dihydrofuran-5-yl-(1,4-dimethylpiperazin-2-yl)methanone

2,3-dihydrofuran-5-yl-(1,4-dimethylpiperazin-2-yl)methanone (PubChem CID 102651036) has the molecular formula C11H18N2O2 and a molecular weight of 210.28 g/mol. Its IUPAC name is 2,3-dihydrofuran-5-yl-(1,4-dimethylpiperazin-2-yl)methanone.

Molecular Properties

Compound Name2,3-dihydrofuran-5-yl-(1,4-dimethylpiperazin-2-yl)methanone
PubChem CID102651036
Molecular FormulaC11H18N2O2
Molecular Weight210.28 g/mol
Exact Mass210.14
IUPAC Name2,3-dihydrofuran-5-yl-(1,4-dimethylpiperazin-2-yl)methanone
SMILESCN1CCN(C)C(C(=O)C2=CCCO2)C1
InChIInChI=1S/C11H18N2O2/c1-12-5-6-13(2)9(8-12)11(14)10-4-3-7-15-10/h4,9H,3,5-8H2,1-2H3
InChIKeyHBDJUWAALWYCQC-UHFFFAOYSA-N
XLogP0.11
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.28
LogP ≤ 50.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

3,4-dihydro-2H-pyran-6-yl-(1,4-dimethylpiperazin-2-yl)methanone
CID 102646959
1,4-diazabicyclo[2.2.2]octan-2-yl(3,4-dihydro-2H-pyran-6-yl)methanone
CID 102646968
3,4-dihydro-2H-pyran-6-yl-(1,4-dimethyl-1,4-diazepan-2-yl)methanone
CID 102647008
1-(2,3-Dihydrofuran-5-yl)-2-methyl-2-piperidin-1-ylpropan-1-one
CID 102651007
2,3-Dihydrofuran-5-yl-(4-propan-2-ylmorpholin-2-yl)methanone
CID 102651039
1,4-Diazabicyclo[2.2.2]octan-2-yl(2,3-dihydrofuran-5-yl)methanone
CID 102651045
1-(2,3-Dihydrofuran-5-yl)-2-(1,4-dimethylpiperazin-2-yl)ethanone
CID 102651080
2,3-Dihydrofuran-5-yl-(1,4-dimethyl-1,4-diazepan-2-yl)methanone
CID 102651085

Frequently Asked Questions

What is the IUPAC name of 2,3-dihydrofuran-5-yl-(1,4-dimethylpiperazin-2-yl)methanone?
The IUPAC name of 2,3-dihydrofuran-5-yl-(1,4-dimethylpiperazin-2-yl)methanone (CID 102651036) is 2,3-dihydrofuran-5-yl-(1,4-dimethylpiperazin-2-yl)methanone.
What is the SMILES notation for 2,3-dihydrofuran-5-yl-(1,4-dimethylpiperazin-2-yl)methanone?
The canonical SMILES for 2,3-dihydrofuran-5-yl-(1,4-dimethylpiperazin-2-yl)methanone is CN1CCN(C)C(C(=O)C2=CCCO2)C1.
What is the InChIKey of 2,3-dihydrofuran-5-yl-(1,4-dimethylpiperazin-2-yl)methanone?
The InChIKey is HBDJUWAALWYCQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O2/c1-12-5-6-13(2)9(8-12)11(14)10-4-3-7-15-10/h4,9H,3,5-8H2,1-2H3.
What are the key properties of 2,3-dihydrofuran-5-yl-(1,4-dimethylpiperazin-2-yl)methanone?
2,3-dihydrofuran-5-yl-(1,4-dimethylpiperazin-2-yl)methanone has a molecular weight of 210.28 g/mol, XLogP of 0.11, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dihydrofuran-5-yl-(1,4-dimethylpiperazin-2-yl)methanone is sourced from PubChem (CID 102651036), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).