1-[4-(1-arsanylethyl)piperazin-1-yl]ethylarsane

C8H20As2N2 — CID 173199975

IUPAC1-[4-(1-arsanylethyl)piperazin-1-yl]ethylarsane
SMILESCC([AsH2])N1CCN(C(C)[AsH2])CC1
InChIInChI=1S/C8H20As2N2/c1-7(9)11-3-5-12(6-4-11)8(2)10/h7-8H,3-6,9-10H2,1-2H3
InChIKeyMLEDUJPDANAXJN-UHFFFAOYSA-N
MW294.11 g/mol
LogP-1.44
Rot. Bonds2

About 1-[4-(1-arsanylethyl)piperazin-1-yl]ethylarsane

1-[4-(1-arsanylethyl)piperazin-1-yl]ethylarsane (PubChem CID 173199975) has the molecular formula C8H20As2N2 and a molecular weight of 294.11 g/mol. Its IUPAC name is 1-[4-(1-arsanylethyl)piperazin-1-yl]ethylarsane.

Molecular Properties

Compound Name1-[4-(1-arsanylethyl)piperazin-1-yl]ethylarsane
PubChem CID173199975
Molecular FormulaC8H20As2N2
Molecular Weight294.11 g/mol
Exact Mass294.01
IUPAC Name1-[4-(1-arsanylethyl)piperazin-1-yl]ethylarsane
SMILESCC([AsH2])N1CCN(C(C)[AsH2])CC1
InChIInChI=1S/C8H20As2N2/c1-7(9)11-3-5-12(6-4-11)8(2)10/h7-8H,3-6,9-10H2,1-2H3
InChIKeyMLEDUJPDANAXJN-UHFFFAOYSA-N
XLogP-1.44
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.11
LogP ≤ 5-1.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Related Compounds

1-(2-(N,N-Dimethylamino)ethyl)-4-methylpiperazine
CID 66908
1,4-Diethylpiperazine
CID 80973
1-Ethyl-4-methylpiperazine
CID 12229105
N,N,N',N'-Tetramethylpiperazine-1,4-diethylamine
CID 82745
1,1,4,4-Tetramethylpiperazine-1,4-diium
CID 81393
1,1,4-Trimethylpiperazin-1-ium
CID 12781743
1-Ethyl-1,4-dimethylpiperazin-1-ium
CID 19774336
1,1,4-Triethylpiperazin-1-ium bromide
CID 139730580
N,N,N'-Trimethyl-N'-(2-(4-methyl-1-piperazinyl)ethyl)ethylenediamine
CID 3016546
2-(4-ethylpiperazin-1-yl)-N,N-dimethylethanamine
CID 19860274
N,N-diethyl-2-(4-ethylpiperazin-1-yl)ethanamine
CID 85520592
N-ethyl-2-(4-ethylpiperazin-1-yl)-N-methylethanamine
CID 168923130

Frequently Asked Questions

What is the IUPAC name of 1-[4-(1-arsanylethyl)piperazin-1-yl]ethylarsane?
The IUPAC name of 1-[4-(1-arsanylethyl)piperazin-1-yl]ethylarsane (CID 173199975) is 1-[4-(1-arsanylethyl)piperazin-1-yl]ethylarsane.
What is the SMILES notation for 1-[4-(1-arsanylethyl)piperazin-1-yl]ethylarsane?
The canonical SMILES for 1-[4-(1-arsanylethyl)piperazin-1-yl]ethylarsane is CC([AsH2])N1CCN(C(C)[AsH2])CC1.
What is the InChIKey of 1-[4-(1-arsanylethyl)piperazin-1-yl]ethylarsane?
The InChIKey is MLEDUJPDANAXJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H20As2N2/c1-7(9)11-3-5-12(6-4-11)8(2)10/h7-8H,3-6,9-10H2,1-2H3.
What are the key properties of 1-[4-(1-arsanylethyl)piperazin-1-yl]ethylarsane?
1-[4-(1-arsanylethyl)piperazin-1-yl]ethylarsane has a molecular weight of 294.11 g/mol, XLogP of -1.44, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-(1-arsanylethyl)piperazin-1-yl]ethylarsane is sourced from PubChem (CID 173199975), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).