2-[2-(ethylamino)ethoxy]ethyl 2-methylprop-2-enoate

C10H19NO3 — CID 54267195

IUPAC2-[2-(ethylamino)ethoxy]ethyl 2-methylprop-2-enoate
SMILESC=C(C)C(=O)OCCOCCNCC
InChIInChI=1S/C10H19NO3/c1-4-11-5-6-13-7-8-14-10(12)9(2)3/h11H,2,4-8H2,1,3H3
InChIKeyRHPBJJPGXGXLDT-UHFFFAOYSA-N
MW201.27 g/mol
LogP0.73
Rot. Bonds8

About 2-[2-(ethylamino)ethoxy]ethyl 2-methylprop-2-enoate

2-[2-(ethylamino)ethoxy]ethyl 2-methylprop-2-enoate (PubChem CID 54267195) has the molecular formula C10H19NO3 and a molecular weight of 201.27 g/mol. Its IUPAC name is 2-[2-(ethylamino)ethoxy]ethyl 2-methylprop-2-enoate.

Molecular Properties

Compound Name2-[2-(ethylamino)ethoxy]ethyl 2-methylprop-2-enoate
PubChem CID54267195
Molecular FormulaC10H19NO3
Molecular Weight201.27 g/mol
Exact Mass201.14
IUPAC Name2-[2-(ethylamino)ethoxy]ethyl 2-methylprop-2-enoate
SMILESC=C(C)C(=O)OCCOCCNCC
InChIInChI=1S/C10H19NO3/c1-4-11-5-6-13-7-8-14-10(12)9(2)3/h11H,2,4-8H2,1,3H3
InChIKeyRHPBJJPGXGXLDT-UHFFFAOYSA-N
XLogP0.73
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.27
LogP ≤ 50.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-[2-(ethylamino)ethoxy]ethyl 2-methylprop-2-enoate?
The IUPAC name of 2-[2-(ethylamino)ethoxy]ethyl 2-methylprop-2-enoate (CID 54267195) is 2-[2-(ethylamino)ethoxy]ethyl 2-methylprop-2-enoate.
What is the SMILES notation for 2-[2-(ethylamino)ethoxy]ethyl 2-methylprop-2-enoate?
The canonical SMILES for 2-[2-(ethylamino)ethoxy]ethyl 2-methylprop-2-enoate is C=C(C)C(=O)OCCOCCNCC.
What is the InChIKey of 2-[2-(ethylamino)ethoxy]ethyl 2-methylprop-2-enoate?
The InChIKey is RHPBJJPGXGXLDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO3/c1-4-11-5-6-13-7-8-14-10(12)9(2)3/h11H,2,4-8H2,1,3H3.
What are the key properties of 2-[2-(ethylamino)ethoxy]ethyl 2-methylprop-2-enoate?
2-[2-(ethylamino)ethoxy]ethyl 2-methylprop-2-enoate has a molecular weight of 201.27 g/mol, XLogP of 0.73, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(ethylamino)ethoxy]ethyl 2-methylprop-2-enoate is sourced from PubChem (CID 54267195), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).