ethyl N-ethenyl-N-methylcarbamate

C6H11NO2 — CID 19875125

IUPACethyl N-ethenyl-N-methylcarbamate
SMILESC=CN(C)C(=O)OCC
InChIInChI=1S/C6H11NO2/c1-4-7(3)6(8)9-5-2/h4H,1,5H2,2-3H3
InChIKeyCJBXJRJIJSTXJL-UHFFFAOYSA-N
MW129.16 g/mol
LogP1.22
Rot. Bonds2

About ethyl N-ethenyl-N-methylcarbamate

ethyl N-ethenyl-N-methylcarbamate (PubChem CID 19875125) has the molecular formula C6H11NO2 and a molecular weight of 129.16 g/mol. Its IUPAC name is ethyl N-ethenyl-N-methylcarbamate.

Molecular Properties

Compound Nameethyl N-ethenyl-N-methylcarbamate
PubChem CID19875125
Molecular FormulaC6H11NO2
Molecular Weight129.16 g/mol
Exact Mass129.08
IUPAC Nameethyl N-ethenyl-N-methylcarbamate
SMILESC=CN(C)C(=O)OCC
InChIInChI=1S/C6H11NO2/c1-4-7(3)6(8)9-5-2/h4H,1,5H2,2-3H3
InChIKeyCJBXJRJIJSTXJL-UHFFFAOYSA-N
XLogP1.22
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500129.16
LogP ≤ 51.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of ethyl N-ethenyl-N-methylcarbamate?
The IUPAC name of ethyl N-ethenyl-N-methylcarbamate (CID 19875125) is ethyl N-ethenyl-N-methylcarbamate.
What is the SMILES notation for ethyl N-ethenyl-N-methylcarbamate?
The canonical SMILES for ethyl N-ethenyl-N-methylcarbamate is C=CN(C)C(=O)OCC.
What is the InChIKey of ethyl N-ethenyl-N-methylcarbamate?
The InChIKey is CJBXJRJIJSTXJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11NO2/c1-4-7(3)6(8)9-5-2/h4H,1,5H2,2-3H3.
What are the key properties of ethyl N-ethenyl-N-methylcarbamate?
ethyl N-ethenyl-N-methylcarbamate has a molecular weight of 129.16 g/mol, XLogP of 1.22, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl N-ethenyl-N-methylcarbamate is sourced from PubChem (CID 19875125), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).