furan-2-yl-[4-(2-methoxyethyl)piperazin-1-yl]methanone

C12H18N2O3 — CID 113073228

IUPACfuran-2-yl-[4-(2-methoxyethyl)piperazin-1-yl]methanone
SMILESCOCCN1CCN(C(=O)c2ccco2)CC1
InChIInChI=1S/C12H18N2O3/c1-16-10-8-13-4-6-14(7-5-13)12(15)11-3-2-9-17-11/h2-3,9H,4-8,10H2,1H3
InChIKeyBZVAGEHCFWTSEO-UHFFFAOYSA-N
MW238.29 g/mol
LogP0.68
Rot. Bonds4

About furan-2-yl-[4-(2-methoxyethyl)piperazin-1-yl]methanone

furan-2-yl-[4-(2-methoxyethyl)piperazin-1-yl]methanone (PubChem CID 113073228) has the molecular formula C12H18N2O3 and a molecular weight of 238.29 g/mol. Its IUPAC name is furan-2-yl-[4-(2-methoxyethyl)piperazin-1-yl]methanone.

Molecular Properties

Compound Namefuran-2-yl-[4-(2-methoxyethyl)piperazin-1-yl]methanone
PubChem CID113073228
Molecular FormulaC12H18N2O3
Molecular Weight238.29 g/mol
Exact Mass238.13
IUPAC Namefuran-2-yl-[4-(2-methoxyethyl)piperazin-1-yl]methanone
SMILESCOCCN1CCN(C(=O)c2ccco2)CC1
InChIInChI=1S/C12H18N2O3/c1-16-10-8-13-4-6-14(7-5-13)12(15)11-3-2-9-17-11/h2-3,9H,4-8,10H2,1H3
InChIKeyBZVAGEHCFWTSEO-UHFFFAOYSA-N
XLogP0.68
TPSA45.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.29
LogP ≤ 50.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

4-[4-(furan-2-carbonyl)piperazin-1-yl]butan-2-one
CID 82131455
2-[4-(furan-2-carbonyl)piperazin-1-yl]ethyl (Z)-3-aminobut-2-enoate
CID 70416273
[4-[2-(4-chlorophenoxy)ethyl]piperazin-1-yl]-(furan-2-yl)methanone
CID 78789988
N-[2-[4-(furan-2-carbonyl)piperazin-1-yl]ethyl]furan-2-carboxamide
CID 4051467
furan-2-yl-[4-(2-methylsulfonylethyl)piperazin-1-yl]methanone
CID 94897133
[5-(furan-2-yl)-1,3-oxazol-4-yl]-[4-(2-methoxyethyl)piperazin-1-yl]methanone
CID 86950986
3-[2-[4-(furan-2-carbonyl)piperazin-1-yl]ethoxy]-2-methylpyran-4-one
CID 162657390
furan-2-yl-[4-(2-methoxyethyl)piperidin-1-yl]methanone
CID 53150870
3-[4-(furan-2-carbonyl)piperazin-1-yl]-1-(4-methylphenyl)propan-1-one
CID 86799659
1-[4-(2-aminoethyl)piperazin-1-yl]-2-[4-(furan-2-carbonyl)piperazin-1-yl]ethane-1,2-dione
CID 108518065
furan-2-yl-[4-[(4-methoxyphenyl)methyl]piperazin-1-yl]methanone
CID 648203
[4-(3-ethyl-3-methylpentyl)piperazin-1-yl]-(furan-2-yl)methanone
CID 71096247

Frequently Asked Questions

What is the IUPAC name of furan-2-yl-[4-(2-methoxyethyl)piperazin-1-yl]methanone?
The IUPAC name of furan-2-yl-[4-(2-methoxyethyl)piperazin-1-yl]methanone (CID 113073228) is furan-2-yl-[4-(2-methoxyethyl)piperazin-1-yl]methanone.
What is the SMILES notation for furan-2-yl-[4-(2-methoxyethyl)piperazin-1-yl]methanone?
The canonical SMILES for furan-2-yl-[4-(2-methoxyethyl)piperazin-1-yl]methanone is COCCN1CCN(C(=O)c2ccco2)CC1.
What is the InChIKey of furan-2-yl-[4-(2-methoxyethyl)piperazin-1-yl]methanone?
The InChIKey is BZVAGEHCFWTSEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O3/c1-16-10-8-13-4-6-14(7-5-13)12(15)11-3-2-9-17-11/h2-3,9H,4-8,10H2,1H3.
What are the key properties of furan-2-yl-[4-(2-methoxyethyl)piperazin-1-yl]methanone?
furan-2-yl-[4-(2-methoxyethyl)piperazin-1-yl]methanone has a molecular weight of 238.29 g/mol, XLogP of 0.68, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for furan-2-yl-[4-(2-methoxyethyl)piperazin-1-yl]methanone is sourced from PubChem (CID 113073228), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).