2-methoxyethyl N-ethylidenecarbamate

C6H11NO3 — CID 142239404

IUPAC2-methoxyethyl N-ethylidenecarbamate
SMILESCC=NC(=O)OCCOC
InChIInChI=1S/C6H11NO3/c1-3-7-6(8)10-5-4-9-2/h3H,4-5H2,1-2H3
InChIKeyMYIQFYZUQPNVKV-UHFFFAOYSA-N
MW145.16 g/mol
LogP0.86
Rot. Bonds3

About 2-methoxyethyl N-ethylidenecarbamate

2-methoxyethyl N-ethylidenecarbamate (PubChem CID 142239404) has the molecular formula C6H11NO3 and a molecular weight of 145.16 g/mol. Its IUPAC name is 2-methoxyethyl N-ethylidenecarbamate.

Molecular Properties

Compound Name2-methoxyethyl N-ethylidenecarbamate
PubChem CID142239404
Molecular FormulaC6H11NO3
Molecular Weight145.16 g/mol
Exact Mass145.07
IUPAC Name2-methoxyethyl N-ethylidenecarbamate
SMILESCC=NC(=O)OCCOC
InChIInChI=1S/C6H11NO3/c1-3-7-6(8)10-5-4-9-2/h3H,4-5H2,1-2H3
InChIKeyMYIQFYZUQPNVKV-UHFFFAOYSA-N
XLogP0.86
TPSA47.89 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.16
LogP ≤ 50.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-methoxyethyl N-ethylidenecarbamate?
The IUPAC name of 2-methoxyethyl N-ethylidenecarbamate (CID 142239404) is 2-methoxyethyl N-ethylidenecarbamate.
What is the SMILES notation for 2-methoxyethyl N-ethylidenecarbamate?
The canonical SMILES for 2-methoxyethyl N-ethylidenecarbamate is CC=NC(=O)OCCOC.
What is the InChIKey of 2-methoxyethyl N-ethylidenecarbamate?
The InChIKey is MYIQFYZUQPNVKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11NO3/c1-3-7-6(8)10-5-4-9-2/h3H,4-5H2,1-2H3.
What are the key properties of 2-methoxyethyl N-ethylidenecarbamate?
2-methoxyethyl N-ethylidenecarbamate has a molecular weight of 145.16 g/mol, XLogP of 0.86, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxyethyl N-ethylidenecarbamate is sourced from PubChem (CID 142239404), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).