2-(2-methoxyprop-2-enoxy)-N,N-dimethylethanamine

C8H17NO2 — CID 88943626

IUPAC2-(2-methoxyprop-2-enoxy)-N,N-dimethylethanamine
SMILESC=C(COCCN(C)C)OC
InChIInChI=1S/C8H17NO2/c1-8(10-4)7-11-6-5-9(2)3/h1,5-7H2,2-4H3
InChIKeyLZNWNJIQNRZQRR-UHFFFAOYSA-N
MW159.23 g/mol
LogP0.72
Rot. Bonds6

About 2-(2-methoxyprop-2-enoxy)-N,N-dimethylethanamine

2-(2-methoxyprop-2-enoxy)-N,N-dimethylethanamine (PubChem CID 88943626) has the molecular formula C8H17NO2 and a molecular weight of 159.23 g/mol. Its IUPAC name is 2-(2-methoxyprop-2-enoxy)-N,N-dimethylethanamine.

Molecular Properties

Compound Name2-(2-methoxyprop-2-enoxy)-N,N-dimethylethanamine
PubChem CID88943626
Molecular FormulaC8H17NO2
Molecular Weight159.23 g/mol
Exact Mass159.13
IUPAC Name2-(2-methoxyprop-2-enoxy)-N,N-dimethylethanamine
SMILESC=C(COCCN(C)C)OC
InChIInChI=1S/C8H17NO2/c1-8(10-4)7-11-6-5-9(2)3/h1,5-7H2,2-4H3
InChIKeyLZNWNJIQNRZQRR-UHFFFAOYSA-N
XLogP0.72
TPSA21.70 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500159.23
LogP ≤ 50.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-(2-methoxyprop-2-enoxy)-N,N-dimethylethanamine?
The IUPAC name of 2-(2-methoxyprop-2-enoxy)-N,N-dimethylethanamine (CID 88943626) is 2-(2-methoxyprop-2-enoxy)-N,N-dimethylethanamine.
What is the SMILES notation for 2-(2-methoxyprop-2-enoxy)-N,N-dimethylethanamine?
The canonical SMILES for 2-(2-methoxyprop-2-enoxy)-N,N-dimethylethanamine is C=C(COCCN(C)C)OC.
What is the InChIKey of 2-(2-methoxyprop-2-enoxy)-N,N-dimethylethanamine?
The InChIKey is LZNWNJIQNRZQRR-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17NO2/c1-8(10-4)7-11-6-5-9(2)3/h1,5-7H2,2-4H3.
What are the key properties of 2-(2-methoxyprop-2-enoxy)-N,N-dimethylethanamine?
2-(2-methoxyprop-2-enoxy)-N,N-dimethylethanamine has a molecular weight of 159.23 g/mol, XLogP of 0.72, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxyprop-2-enoxy)-N,N-dimethylethanamine is sourced from PubChem (CID 88943626), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).