N,N'-bis(2-methoxyethyl)-N'-prop-2-enylethane-1,2-diamine

C11H24N2O2 — CID 103339442

IUPACN,N'-bis(2-methoxyethyl)-N'-prop-2-enylethane-1,2-diamine
SMILESC=CCN(CCNCCOC)CCOC
InChIInChI=1S/C11H24N2O2/c1-4-7-13(9-11-15-3)8-5-12-6-10-14-2/h4,12H,1,5-11H2,2-3H3
InChIKeyYOUDEHPWMHEFAQ-UHFFFAOYSA-N
MW216.32 g/mol
LogP0.36
Rot. Bonds11

About N,N'-bis(2-methoxyethyl)-N'-prop-2-enylethane-1,2-diamine

N,N'-bis(2-methoxyethyl)-N'-prop-2-enylethane-1,2-diamine (PubChem CID 103339442) has the molecular formula C11H24N2O2 and a molecular weight of 216.32 g/mol. Its IUPAC name is N,N'-bis(2-methoxyethyl)-N'-prop-2-enylethane-1,2-diamine.

Molecular Properties

Compound NameN,N'-bis(2-methoxyethyl)-N'-prop-2-enylethane-1,2-diamine
PubChem CID103339442
Molecular FormulaC11H24N2O2
Molecular Weight216.32 g/mol
Exact Mass216.18
IUPAC NameN,N'-bis(2-methoxyethyl)-N'-prop-2-enylethane-1,2-diamine
SMILESC=CCN(CCNCCOC)CCOC
InChIInChI=1S/C11H24N2O2/c1-4-7-13(9-11-15-3)8-5-12-6-10-14-2/h4,12H,1,5-11H2,2-3H3
InChIKeyYOUDEHPWMHEFAQ-UHFFFAOYSA-N
XLogP0.36
TPSA33.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds11
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.32
LogP ≤ 50.36
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'}

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Frequently Asked Questions

What is the IUPAC name of N,N'-bis(2-methoxyethyl)-N'-prop-2-enylethane-1,2-diamine?
The IUPAC name of N,N'-bis(2-methoxyethyl)-N'-prop-2-enylethane-1,2-diamine (CID 103339442) is N,N'-bis(2-methoxyethyl)-N'-prop-2-enylethane-1,2-diamine.
What is the SMILES notation for N,N'-bis(2-methoxyethyl)-N'-prop-2-enylethane-1,2-diamine?
The canonical SMILES for N,N'-bis(2-methoxyethyl)-N'-prop-2-enylethane-1,2-diamine is C=CCN(CCNCCOC)CCOC.
What is the InChIKey of N,N'-bis(2-methoxyethyl)-N'-prop-2-enylethane-1,2-diamine?
The InChIKey is YOUDEHPWMHEFAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O2/c1-4-7-13(9-11-15-3)8-5-12-6-10-14-2/h4,12H,1,5-11H2,2-3H3.
What are the key properties of N,N'-bis(2-methoxyethyl)-N'-prop-2-enylethane-1,2-diamine?
N,N'-bis(2-methoxyethyl)-N'-prop-2-enylethane-1,2-diamine has a molecular weight of 216.32 g/mol, XLogP of 0.36, 11 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N'-bis(2-methoxyethyl)-N'-prop-2-enylethane-1,2-diamine is sourced from PubChem (CID 103339442), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).