1-[(5-ethylfuran-2-yl)methyl]piperazine

C11H18N2O — CID 62346737

IUPAC1-[(5-ethylfuran-2-yl)methyl]piperazine
SMILESCCc1ccc(CN2CCNCC2)o1
InChIInChI=1S/C11H18N2O/c1-2-10-3-4-11(14-10)9-13-7-5-12-6-8-13/h3-4,12H,2,5-9H2,1H3
InChIKeyAFIYEXHLRUDAPC-UHFFFAOYSA-N
MW194.28 g/mol
LogP1.25
Rot. Bonds3

About 1-[(5-ethylfuran-2-yl)methyl]piperazine

1-[(5-ethylfuran-2-yl)methyl]piperazine (PubChem CID 62346737) has the molecular formula C11H18N2O and a molecular weight of 194.28 g/mol. Its IUPAC name is 1-[(5-ethylfuran-2-yl)methyl]piperazine.

Molecular Properties

Compound Name1-[(5-ethylfuran-2-yl)methyl]piperazine
PubChem CID62346737
Molecular FormulaC11H18N2O
Molecular Weight194.28 g/mol
Exact Mass194.14
IUPAC Name1-[(5-ethylfuran-2-yl)methyl]piperazine
SMILESCCc1ccc(CN2CCNCC2)o1
InChIInChI=1S/C11H18N2O/c1-2-10-3-4-11(14-10)9-13-7-5-12-6-8-13/h3-4,12H,2,5-9H2,1H3
InChIKeyAFIYEXHLRUDAPC-UHFFFAOYSA-N
XLogP1.25
TPSA28.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.28
LogP ≤ 51.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[(5-bromofuran-2-yl)methyl]piperazine
CID 43143137
5-(piperazin-1-ylmethyl)furan-2-amine
CID 82503886
1-[(5-ethylfuran-2-yl)methyl]-4-ethylsulfonylpiperazine
CID 75438528
2-(5-ethylfuran-2-yl)-1-piperazin-1-ylethanone
CID 82509435
1-[(5-nitrofuran-2-yl)methyl]piperazine
CID 43143138
1-[(5-ethylfuran-2-yl)methyl]-4-methylpiperidine-4-carboxylic acid
CID 65064757
[1-[(5-ethylfuran-2-yl)methyl]pyrrolidin-2-yl]-piperazin-1-ylmethanone
CID 62346739
1-[(2-ethylphenyl)methyl]piperazine
CID 62415674
1-[(1R)-1-(5-ethylfuran-2-yl)propyl]piperazine;dihydrochloride
CID 171295119
4-[[5-(morpholin-4-ylmethyl)furan-2-yl]methyl]morpholine
CID 155546801
1-[(5-ethylfuran-2-yl)methyl]-4-(thiophen-3-ylmethyl)-1,4-diazepane
CID 3343047
[5-(3,9-diazaspiro[5.5]undecan-3-ylmethyl)furan-2-yl]methanol
CID 56917105

Frequently Asked Questions

What is the IUPAC name of 1-[(5-ethylfuran-2-yl)methyl]piperazine?
The IUPAC name of 1-[(5-ethylfuran-2-yl)methyl]piperazine (CID 62346737) is 1-[(5-ethylfuran-2-yl)methyl]piperazine.
What is the SMILES notation for 1-[(5-ethylfuran-2-yl)methyl]piperazine?
The canonical SMILES for 1-[(5-ethylfuran-2-yl)methyl]piperazine is CCc1ccc(CN2CCNCC2)o1.
What is the InChIKey of 1-[(5-ethylfuran-2-yl)methyl]piperazine?
The InChIKey is AFIYEXHLRUDAPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O/c1-2-10-3-4-11(14-10)9-13-7-5-12-6-8-13/h3-4,12H,2,5-9H2,1H3.
What are the key properties of 1-[(5-ethylfuran-2-yl)methyl]piperazine?
1-[(5-ethylfuran-2-yl)methyl]piperazine has a molecular weight of 194.28 g/mol, XLogP of 1.25, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(5-ethylfuran-2-yl)methyl]piperazine is sourced from PubChem (CID 62346737), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).