2-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]-2-prop-2-enylpent-4-en-1-amine

C15H29NO3 — CID 170682425

IUPAC2-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]-2-prop-2-enylpent-4-en-1-amine
SMILESC=CCC(CN)(CC=C)CCOCCOCCOC
InChIInChI=1S/C15H29NO3/c1-4-6-15(14-16,7-5-2)8-9-18-12-13-19-11-10-17-3/h4-5H,1-2,6-14,16H2,3H3
InChIKeyQQZHVTLNCCWZJF-UHFFFAOYSA-N
MW271.40 g/mol
LogP2.15
Rot. Bonds14

About 2-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]-2-prop-2-enylpent-4-en-1-amine

2-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]-2-prop-2-enylpent-4-en-1-amine (PubChem CID 170682425) has the molecular formula C15H29NO3 and a molecular weight of 271.40 g/mol. Its IUPAC name is 2-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]-2-prop-2-enylpent-4-en-1-amine.

Molecular Properties

Compound Name2-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]-2-prop-2-enylpent-4-en-1-amine
PubChem CID170682425
Molecular FormulaC15H29NO3
Molecular Weight271.40 g/mol
Exact Mass271.21
IUPAC Name2-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]-2-prop-2-enylpent-4-en-1-amine
SMILESC=CCC(CN)(CC=C)CCOCCOCCOC
InChIInChI=1S/C15H29NO3/c1-4-6-15(14-16,7-5-2)8-9-18-12-13-19-11-10-17-3/h4-5H,1-2,6-14,16H2,3H3
InChIKeyQQZHVTLNCCWZJF-UHFFFAOYSA-N
XLogP2.15
TPSA53.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds14
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.40
LogP ≤ 52.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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-methoxyethoxy)ethoxy]ethyl]-2-prop-2-enylpent-4-en-1-amine with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]-2-prop-2-enylpent-4-en-1-amine?
The IUPAC name of 2-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]-2-prop-2-enylpent-4-en-1-amine (CID 170682425) is 2-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]-2-prop-2-enylpent-4-en-1-amine.
What is the SMILES notation for 2-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]-2-prop-2-enylpent-4-en-1-amine?
The canonical SMILES for 2-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]-2-prop-2-enylpent-4-en-1-amine is C=CCC(CN)(CC=C)CCOCCOCCOC.
What is the InChIKey of 2-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]-2-prop-2-enylpent-4-en-1-amine?
The InChIKey is QQZHVTLNCCWZJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29NO3/c1-4-6-15(14-16,7-5-2)8-9-18-12-13-19-11-10-17-3/h4-5H,1-2,6-14,16H2,3H3.
What are the key properties of 2-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]-2-prop-2-enylpent-4-en-1-amine?
2-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]-2-prop-2-enylpent-4-en-1-amine has a molecular weight of 271.40 g/mol, XLogP of 2.15, 14 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]-2-prop-2-enylpent-4-en-1-amine is sourced from PubChem (CID 170682425), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).