N,N-bis[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]aniline

C56H107NO24 — CID 169196905

IUPACN,N-bis[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]aniline
SMILESCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCN(CCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOC)c1ccccc1
InChIInChI=1S/C56H107NO24/c1-58-12-14-62-20-22-66-28-30-70-36-38-74-44-46-78-52-54-80-50-48-76-42-40-72-34-32-68-26-24-64-18-16-60-10-8-57(56-6-4-3-5-7-56)9-11-61-17-19-65-25-27-69-33-35-73-41-43-77-49-51-81-55-53-79-47-45-75-39-37-71-31-29-67-23-21-63-15-13-59-2/h3-7H,8-55H2,1-2H3
InChIKeyDOHKPVPMCQDRTJ-UHFFFAOYSA-N
MW1178.45 g/mol
LogP2.15
Rot. Bonds73

About N,N-bis[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]aniline

N,N-bis[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]aniline (PubChem CID 169196905) has the molecular formula C56H107NO24 and a molecular weight of 1178.45 g/mol. Its IUPAC name is N,N-bis[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]aniline.

Molecular Properties

Compound NameN,N-bis[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]aniline
PubChem CID169196905
Molecular FormulaC56H107NO24
Molecular Weight1178.45 g/mol
Exact Mass1177.72
IUPAC NameN,N-bis[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]aniline
SMILESCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCN(CCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOC)c1ccccc1
InChIInChI=1S/C56H107NO24/c1-58-12-14-62-20-22-66-28-30-70-36-38-74-44-46-78-52-54-80-50-48-76-42-40-72-34-32-68-26-24-64-18-16-60-10-8-57(56-6-4-3-5-7-56)9-11-61-17-19-65-25-27-69-33-35-73-41-43-77-49-51-81-55-53-79-47-45-75-39-37-71-31-29-67-23-21-63-15-13-59-2/h3-7H,8-55H2,1-2H3
InChIKeyDOHKPVPMCQDRTJ-UHFFFAOYSA-N
XLogP2.15
TPSA224.76 Ų
H-Bond Donors
H-Bond Acceptors25
Rotatable Bonds73
Heavy Atoms81
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001178.45
LogP ≤ 52.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1025

Computed Properties (RDKit)

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

Analyze N,N-bis[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]aniline with MolForge

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Related Compounds

N-butyl-N-[2-(2-methoxyethoxy)ethyl]aniline
CID 164933283
N'-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]-N'-phenylpropane-1,3-diamine
CID 104561042
3-methoxy-N,N-bis[2-(2-methoxyethoxy)ethyl]aniline
CID 156565420
N-[2-(2-methoxyethoxy)ethyl]-N-(2-methoxyethyl)-3-methylaniline
CID 124925556
3-[bis[2-(2-methoxyethoxy)ethyl]amino]phenol
CID 59211296
4-[N-[3-(2-methoxyethoxy)propyl]anilino]butanoic acid
CID 103410825
3-methoxy-N-[2-(2-methoxyethoxy)ethyl]-N-(2-methoxyethyl)aniline
CID 166462130
3-[N-[2-(3-methoxypropoxy)ethyl]anilino]propanenitrile
CID 103179680
2-[2-[N-[2-(2-methylsulfonyloxyethoxy)ethyl]anilino]ethoxy]ethyl methanesulfonate
CID 89334381
2,4-bis[4-[bis[2-(2-methoxyethoxy)ethyl]amino]phenyl]cyclobuta-1,3-diene-1,3-diol
CID 102029569
2-(2-methoxyethoxy)-N,N-bis[2-(2-methoxyethoxy)ethyl]ethanamine;toluene
CID 118437277
N,N,2-tris[2-(2-methoxyethoxy)ethyl]aniline
CID 150684481

Frequently Asked Questions

What is the IUPAC name of N,N-bis[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]aniline?
The IUPAC name of N,N-bis[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]aniline (CID 169196905) is N,N-bis[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]aniline.
What is the SMILES notation for N,N-bis[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]aniline?
The canonical SMILES for N,N-bis[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]aniline is COCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCN(CCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOC)c1ccccc1.
What is the InChIKey of N,N-bis[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]aniline?
The InChIKey is DOHKPVPMCQDRTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C56H107NO24/c1-58-12-14-62-20-22-66-28-30-70-36-38-74-44-46-78-52-54-80-50-48-76-42-40-72-34-32-68-26-24-64-18-16-60-10-8-57(56-6-4-3-5-7-56)9-11-61-17-19-65-25-27-69-33-35-73-41-43-77-49-51-81-55-53-79-47-45-75-39-37-71-31-29-67-23-21-63-15-13-59-2/h3-7H,8-55H2,1-2H3.
What are the key properties of N,N-bis[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]aniline?
N,N-bis[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]aniline has a molecular weight of 1178.45 g/mol, XLogP of 2.15, 73 rotatable bonds, 0 hydrogen bond donors, and 25 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-bis[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]aniline is sourced from PubChem (CID 169196905), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).