2-[2-(ethylidenecarbamoyloxy)ethoxy]ethyl N-ethylidenecarbamate

C10H16N2O5 — CID 91083408

IUPAC2-[2-(ethylidenecarbamoyloxy)ethoxy]ethyl N-ethylidenecarbamate
SMILESCC=NC(=O)OCCOCCOC(=O)N=CC
InChIInChI=1S/C10H16N2O5/c1-3-11-9(13)16-7-5-15-6-8-17-10(14)12-4-2/h3-4H,5-8H2,1-2H3
InChIKeyUXYWFEWJGWSJJE-UHFFFAOYSA-N
MW244.25 g/mol
LogP1.46
Rot. Bonds6

About 2-[2-(ethylidenecarbamoyloxy)ethoxy]ethyl N-ethylidenecarbamate

2-[2-(ethylidenecarbamoyloxy)ethoxy]ethyl N-ethylidenecarbamate (PubChem CID 91083408) has the molecular formula C10H16N2O5 and a molecular weight of 244.25 g/mol. Its IUPAC name is 2-[2-(ethylidenecarbamoyloxy)ethoxy]ethyl N-ethylidenecarbamate.

Molecular Properties

Compound Name2-[2-(ethylidenecarbamoyloxy)ethoxy]ethyl N-ethylidenecarbamate
PubChem CID91083408
Molecular FormulaC10H16N2O5
Molecular Weight244.25 g/mol
Exact Mass244.11
IUPAC Name2-[2-(ethylidenecarbamoyloxy)ethoxy]ethyl N-ethylidenecarbamate
SMILESCC=NC(=O)OCCOCCOC(=O)N=CC
InChIInChI=1S/C10H16N2O5/c1-3-11-9(13)16-7-5-15-6-8-17-10(14)12-4-2/h3-4H,5-8H2,1-2H3
InChIKeyUXYWFEWJGWSJJE-UHFFFAOYSA-N
XLogP1.46
TPSA86.55 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.25
LogP ≤ 51.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

Glyoxal, bis(ethoxycarbonylamido-
CID 9576729
ethyl N-(4-ethoxycarbonyliminobutylidene)carbamate
CID 57086784
N-[2-[2-(2-acetyliminoethoxy)ethoxy]ethylidene]acetamide
CID 140977215
ethyl N-(2-ethoxycarbonyliminoethylidene)carbamate
CID 118887
2-methoxyethyl N-ethylidenecarbamate
CID 142239404

Frequently Asked Questions

What is the IUPAC name of 2-[2-(ethylidenecarbamoyloxy)ethoxy]ethyl N-ethylidenecarbamate?
The IUPAC name of 2-[2-(ethylidenecarbamoyloxy)ethoxy]ethyl N-ethylidenecarbamate (CID 91083408) is 2-[2-(ethylidenecarbamoyloxy)ethoxy]ethyl N-ethylidenecarbamate.
What is the SMILES notation for 2-[2-(ethylidenecarbamoyloxy)ethoxy]ethyl N-ethylidenecarbamate?
The canonical SMILES for 2-[2-(ethylidenecarbamoyloxy)ethoxy]ethyl N-ethylidenecarbamate is CC=NC(=O)OCCOCCOC(=O)N=CC.
What is the InChIKey of 2-[2-(ethylidenecarbamoyloxy)ethoxy]ethyl N-ethylidenecarbamate?
The InChIKey is UXYWFEWJGWSJJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O5/c1-3-11-9(13)16-7-5-15-6-8-17-10(14)12-4-2/h3-4H,5-8H2,1-2H3.
What are the key properties of 2-[2-(ethylidenecarbamoyloxy)ethoxy]ethyl N-ethylidenecarbamate?
2-[2-(ethylidenecarbamoyloxy)ethoxy]ethyl N-ethylidenecarbamate has a molecular weight of 244.25 g/mol, XLogP of 1.46, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(ethylidenecarbamoyloxy)ethoxy]ethyl N-ethylidenecarbamate is sourced from PubChem (CID 91083408), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).