N-ethenyl-2-[2-[2-[2-[2-[2-[2-[2-(3-methylpenta-3,4-dienoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanamine

C24H45NO8 — CID 155276531

IUPACN-ethenyl-2-[2-[2-[2-[2-[2-[2-[2-(3-methylpenta-3,4-dienoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanamine
SMILESC=C=C(C)CCOCCOCCOCCOCCOCCOCCOCCOCCNC=C
InChIInChI=1S/C24H45NO8/c1-4-24(3)6-8-26-10-12-28-14-16-30-18-20-32-22-23-33-21-19-31-17-15-29-13-11-27-9-7-25-5-2/h5,25H,1-2,6-23H2,3H3
InChIKeyQVJCQDNCQJYOCY-UHFFFAOYSA-N
MW475.62 g/mol
LogP1.97
Rot. Bonds28

About N-ethenyl-2-[2-[2-[2-[2-[2-[2-[2-(3-methylpenta-3,4-dienoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanamine

N-ethenyl-2-[2-[2-[2-[2-[2-[2-[2-(3-methylpenta-3,4-dienoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanamine (PubChem CID 155276531) has the molecular formula C24H45NO8 and a molecular weight of 475.62 g/mol. Its IUPAC name is N-ethenyl-2-[2-[2-[2-[2-[2-[2-[2-(3-methylpenta-3,4-dienoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanamine.

Molecular Properties

Compound NameN-ethenyl-2-[2-[2-[2-[2-[2-[2-[2-(3-methylpenta-3,4-dienoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanamine
PubChem CID155276531
Molecular FormulaC24H45NO8
Molecular Weight475.62 g/mol
Exact Mass475.31
IUPAC NameN-ethenyl-2-[2-[2-[2-[2-[2-[2-[2-(3-methylpenta-3,4-dienoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanamine
SMILESC=C=C(C)CCOCCOCCOCCOCCOCCOCCOCCOCCNC=C
InChIInChI=1S/C24H45NO8/c1-4-24(3)6-8-26-10-12-28-14-16-30-18-20-32-22-23-33-21-19-31-17-15-29-13-11-27-9-7-25-5-2/h5,25H,1-2,6-23H2,3H3
InChIKeyQVJCQDNCQJYOCY-UHFFFAOYSA-N
XLogP1.97
TPSA85.87 Ų
H-Bond Donors1
H-Bond Acceptors9
Rotatable Bonds28
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500475.62
LogP ≤ 51.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 109

Computed Properties (RDKit)

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

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Related Compounds

ethane;N-methyl-2-[2-[2-[2-(3-methylbut-3-enoxy)ethoxy]ethoxy]ethoxy]ethanamine
CID 142382423
N-methyl-2-[2-[2-[2-(3-methylbut-3-enoxy)ethoxy]ethoxy]ethoxy]ethanamine
CID 142382424

Frequently Asked Questions

What is the IUPAC name of N-ethenyl-2-[2-[2-[2-[2-[2-[2-[2-(3-methylpenta-3,4-dienoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanamine?
The IUPAC name of N-ethenyl-2-[2-[2-[2-[2-[2-[2-[2-(3-methylpenta-3,4-dienoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanamine (CID 155276531) is N-ethenyl-2-[2-[2-[2-[2-[2-[2-[2-(3-methylpenta-3,4-dienoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanamine.
What is the SMILES notation for N-ethenyl-2-[2-[2-[2-[2-[2-[2-[2-(3-methylpenta-3,4-dienoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanamine?
The canonical SMILES for N-ethenyl-2-[2-[2-[2-[2-[2-[2-[2-(3-methylpenta-3,4-dienoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanamine is C=C=C(C)CCOCCOCCOCCOCCOCCOCCOCCOCCNC=C.
What is the InChIKey of N-ethenyl-2-[2-[2-[2-[2-[2-[2-[2-(3-methylpenta-3,4-dienoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanamine?
The InChIKey is QVJCQDNCQJYOCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H45NO8/c1-4-24(3)6-8-26-10-12-28-14-16-30-18-20-32-22-23-33-21-19-31-17-15-29-13-11-27-9-7-25-5-2/h5,25H,1-2,6-23H2,3H3.
What are the key properties of N-ethenyl-2-[2-[2-[2-[2-[2-[2-[2-(3-methylpenta-3,4-dienoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanamine?
N-ethenyl-2-[2-[2-[2-[2-[2-[2-[2-(3-methylpenta-3,4-dienoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanamine has a molecular weight of 475.62 g/mol, XLogP of 1.97, 28 rotatable bonds, 1 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethenyl-2-[2-[2-[2-[2-[2-[2-[2-(3-methylpenta-3,4-dienoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanamine is sourced from PubChem (CID 155276531), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).