1-[2-[2-[2-[2-[2-[2-[2-(2-azidoethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]piperazine

C20H41N5O7 — CID 118226138

IUPAC1-[2-[2-[2-[2-[2-[2-[2-(2-azidoethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]piperazine
SMILES[N-]=[N+]=NCCOCCOCCOCCOCCOCCOCCOCCN1CCNCC1
InChIInChI=1S/C20H41N5O7/c21-24-23-3-7-26-9-11-28-13-15-30-17-19-32-20-18-31-16-14-29-12-10-27-8-6-25-4-1-22-2-5-25/h22H,1-20H2
InChIKeyRULLYETVKYSYTQ-UHFFFAOYSA-N
MW463.58 g/mol
LogP0.32
Rot. Bonds24

About 1-[2-[2-[2-[2-[2-[2-[2-(2-azidoethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]piperazine

1-[2-[2-[2-[2-[2-[2-[2-(2-azidoethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]piperazine (PubChem CID 118226138) has the molecular formula C20H41N5O7 and a molecular weight of 463.58 g/mol. Its IUPAC name is 1-[2-[2-[2-[2-[2-[2-[2-(2-azidoethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]piperazine.

Molecular Properties

Compound Name1-[2-[2-[2-[2-[2-[2-[2-(2-azidoethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]piperazine
PubChem CID118226138
Molecular FormulaC20H41N5O7
Molecular Weight463.58 g/mol
Exact Mass463.30
IUPAC Name1-[2-[2-[2-[2-[2-[2-[2-(2-azidoethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]piperazine
SMILES[N-]=[N+]=NCCOCCOCCOCCOCCOCCOCCOCCN1CCNCC1
InChIInChI=1S/C20H41N5O7/c21-24-23-3-7-26-9-11-28-13-15-30-17-19-32-20-18-31-16-14-29-12-10-27-8-6-25-4-1-22-2-5-25/h22H,1-20H2
InChIKeyRULLYETVKYSYTQ-UHFFFAOYSA-N
XLogP0.32
TPSA128.64 Ų
H-Bond Donors1
H-Bond Acceptors10
Rotatable Bonds24
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500463.58
LogP ≤ 50.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 1010

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Azido_group', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_3', 'substructure': 'N/A'}

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Related Compounds

1-[2-[2-[2-(2-azidoethoxy)ethoxy]ethoxy]ethyl]piperazine
CID 118226200
1-[2-[2-[2-(2-azidoethoxy)ethoxy]ethoxy]ethyl]-4-chloropiperazine
CID 118233347
1-[2-(2-nitrosoethoxy)ethyl]piperazine
CID 89331128
1-azido-2-[2-[2-[2-[2-[2-(2-azidoethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethane
CID 118796295
1-azido-2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-azidoethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethane
CID 165429946
ethane;1-[2-(2-methoxyethoxy)ethyl]piperazine
CID 142390482
1-(2-piperazin-1-ylethoxymethyl)piperazine
CID 167474718
4-[2-(2-azidoethoxy)ethoxy]piperidine
CID 135207381
(2R)-2-acetamido-N-[(2S)-1-[2-(2-azidoethoxy)ethylamino]-1,4-dioxo-4-(2-piperazin-1-ylethylamino)butan-2-yl]-N'-(2-piperazin-1-ylethyl)butanediamide
CID 59561991
1-[2-[2-(2-butoxyethoxy)ethoxy]ethyl]-1,4-diazepane
CID 104560345
ethane;1-[2-(3-methylbutoxy)ethyl]piperazine
CID 176984616
1,5-bis(2-azidoethoxy)-3,3-bis[2-(2-azidoethoxy)ethyl]pentane
CID 140930764

Frequently Asked Questions

What is the IUPAC name of 1-[2-[2-[2-[2-[2-[2-[2-(2-azidoethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]piperazine?
The IUPAC name of 1-[2-[2-[2-[2-[2-[2-[2-(2-azidoethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]piperazine (CID 118226138) is 1-[2-[2-[2-[2-[2-[2-[2-(2-azidoethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]piperazine.
What is the SMILES notation for 1-[2-[2-[2-[2-[2-[2-[2-(2-azidoethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]piperazine?
The canonical SMILES for 1-[2-[2-[2-[2-[2-[2-[2-(2-azidoethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]piperazine is [N-]=[N+]=NCCOCCOCCOCCOCCOCCOCCOCCN1CCNCC1.
What is the InChIKey of 1-[2-[2-[2-[2-[2-[2-[2-(2-azidoethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]piperazine?
The InChIKey is RULLYETVKYSYTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H41N5O7/c21-24-23-3-7-26-9-11-28-13-15-30-17-19-32-20-18-31-16-14-29-12-10-27-8-6-25-4-1-22-2-5-25/h22H,1-20H2.
What are the key properties of 1-[2-[2-[2-[2-[2-[2-[2-(2-azidoethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]piperazine?
1-[2-[2-[2-[2-[2-[2-[2-(2-azidoethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]piperazine has a molecular weight of 463.58 g/mol, XLogP of 0.32, 24 rotatable bonds, 1 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[2-[2-[2-[2-[2-[2-(2-azidoethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]piperazine is sourced from PubChem (CID 118226138), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).