2-[2-[2-[2-[2,2-bis[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxymethyl]-3-prop-2-enoxypropoxy]ethoxy]ethoxy]ethoxy]-N-methylethanamine

C35H71NO15 — CID 123473383

IUPAC2-[2-[2-[2-[2,2-bis[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxymethyl]-3-prop-2-enoxypropoxy]ethoxy]ethoxy]ethoxy]-N-methylethanamine
SMILESC=CCOCC(COCCOCCOCCOCCNC)(COCCOCCOCCOCCOC)COCCOCCOCCOCCOC
InChIInChI=1S/C35H71NO15/c1-5-7-48-31-35(32-49-28-25-45-22-19-42-14-13-39-8-6-36-2,33-50-29-26-46-23-20-43-17-15-40-11-9-37-3)34-51-30-27-47-24-21-44-18-16-41-12-10-38-4/h5,36H,1,6-34H2,2-4H3
InChIKeyJAZFVANIXOWZJP-UHFFFAOYSA-N
MW745.94 g/mol
LogP0.89
Rot. Bonds46

About 2-[2-[2-[2-[2,2-bis[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxymethyl]-3-prop-2-enoxypropoxy]ethoxy]ethoxy]ethoxy]-N-methylethanamine

2-[2-[2-[2-[2,2-bis[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxymethyl]-3-prop-2-enoxypropoxy]ethoxy]ethoxy]ethoxy]-N-methylethanamine (PubChem CID 123473383) has the molecular formula C35H71NO15 and a molecular weight of 745.94 g/mol. Its IUPAC name is 2-[2-[2-[2-[2,2-bis[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxymethyl]-3-prop-2-enoxypropoxy]ethoxy]ethoxy]ethoxy]-N-methylethanamine.

Molecular Properties

Compound Name2-[2-[2-[2-[2,2-bis[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxymethyl]-3-prop-2-enoxypropoxy]ethoxy]ethoxy]ethoxy]-N-methylethanamine
PubChem CID123473383
Molecular FormulaC35H71NO15
Molecular Weight745.94 g/mol
Exact Mass745.48
IUPAC Name2-[2-[2-[2-[2,2-bis[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxymethyl]-3-prop-2-enoxypropoxy]ethoxy]ethoxy]ethoxy]-N-methylethanamine
SMILESC=CCOCC(COCCOCCOCCOCCNC)(COCCOCCOCCOCCOC)COCCOCCOCCOCCOC
InChIInChI=1S/C35H71NO15/c1-5-7-48-31-35(32-49-28-25-45-22-19-42-14-13-39-8-6-36-2,33-50-29-26-46-23-20-43-17-15-40-11-9-37-3)34-51-30-27-47-24-21-44-18-16-41-12-10-38-4/h5,36H,1,6-34H2,2-4H3
InChIKeyJAZFVANIXOWZJP-UHFFFAOYSA-N
XLogP0.89
TPSA150.48 Ų
H-Bond Donors1
H-Bond Acceptors16
Rotatable Bonds46
Heavy Atoms51
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500745.94
LogP ≤ 50.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 1016

Computed Properties (RDKit)

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

Analyze 2-[2-[2-[2-[2,2-bis[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxymethyl]-3-prop-2-enoxypropoxy]ethoxy]ethoxy]ethoxy]-N-methylethanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-methyl-2-(2-prop-2-enoxyethoxy)ethanamine
CID 164530656
2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]-N-methylethanamine
CID 146502176
2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]-N-methylethanamine
CID 86705991
2-[2-(2-methoxyethoxy)ethoxy]-N-methylethanamine;1-methoxy-2-(2-methoxyethoxy)ethane
CID 168897586
ethane;2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]-N-methylethanamine
CID 163400177
1-ethenoxy-3-(2-methoxyethoxy)-2,2-bis(2-methoxyethoxymethyl)propane
CID 159060039
1-[2-[2-(2-fluoroethoxy)ethoxy]ethoxy]-3-prop-2-enoxy-2,2-bis(prop-2-enoxymethyl)propane
CID 125489573
N-methyl-2-[2-[2-[2-[2-[2-[2-[2-(methylamino)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanamine
CID 146243407
2-[2-(4-methoxybutoxy)ethoxy]-N-methylethanamine
CID 135175798
ethene;N-methyl-2-[2-(methylamino)ethoxy]ethanamine
CID 158445143
1-ethoxy-3-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]-2,2-bis[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxymethyl]propane
CID 123158943
ethane;3-[3-(2-methoxyethoxy)propoxy]-N-methylpropan-1-amine
CID 176551886

Frequently Asked Questions

What is the IUPAC name of 2-[2-[2-[2-[2,2-bis[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxymethyl]-3-prop-2-enoxypropoxy]ethoxy]ethoxy]ethoxy]-N-methylethanamine?
The IUPAC name of 2-[2-[2-[2-[2,2-bis[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxymethyl]-3-prop-2-enoxypropoxy]ethoxy]ethoxy]ethoxy]-N-methylethanamine (CID 123473383) is 2-[2-[2-[2-[2,2-bis[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxymethyl]-3-prop-2-enoxypropoxy]ethoxy]ethoxy]ethoxy]-N-methylethanamine.
What is the SMILES notation for 2-[2-[2-[2-[2,2-bis[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxymethyl]-3-prop-2-enoxypropoxy]ethoxy]ethoxy]ethoxy]-N-methylethanamine?
The canonical SMILES for 2-[2-[2-[2-[2,2-bis[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxymethyl]-3-prop-2-enoxypropoxy]ethoxy]ethoxy]ethoxy]-N-methylethanamine is C=CCOCC(COCCOCCOCCOCCNC)(COCCOCCOCCOCCOC)COCCOCCOCCOCCOC.
What is the InChIKey of 2-[2-[2-[2-[2,2-bis[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxymethyl]-3-prop-2-enoxypropoxy]ethoxy]ethoxy]ethoxy]-N-methylethanamine?
The InChIKey is JAZFVANIXOWZJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C35H71NO15/c1-5-7-48-31-35(32-49-28-25-45-22-19-42-14-13-39-8-6-36-2,33-50-29-26-46-23-20-43-17-15-40-11-9-37-3)34-51-30-27-47-24-21-44-18-16-41-12-10-38-4/h5,36H,1,6-34H2,2-4H3.
What are the key properties of 2-[2-[2-[2-[2,2-bis[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxymethyl]-3-prop-2-enoxypropoxy]ethoxy]ethoxy]ethoxy]-N-methylethanamine?
2-[2-[2-[2-[2,2-bis[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxymethyl]-3-prop-2-enoxypropoxy]ethoxy]ethoxy]ethoxy]-N-methylethanamine has a molecular weight of 745.94 g/mol, XLogP of 0.89, 46 rotatable bonds, 1 hydrogen bond donors, and 16 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[2-[2-[2,2-bis[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxymethyl]-3-prop-2-enoxypropoxy]ethoxy]ethoxy]ethoxy]-N-methylethanamine is sourced from PubChem (CID 123473383), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).