2-ethoxy-1-azacycloundecene

C12H23NO — CID 14018635

IUPAC2-ethoxy-1-azacycloundecene
SMILESCCO/C1=N/CCCCCCCCC1
InChIInChI=1S/C12H23NO/c1-2-14-12-10-8-6-4-3-5-7-9-11-13-12/h2-11H2,1H3/b13-12+
InChIKeyLOGDBICYMOBJJN-OUKQBFOZSA-N
MW197.32 g/mol
LogP3.56
Rot. Bonds1

About 2-ethoxy-1-azacycloundecene

2-ethoxy-1-azacycloundecene (PubChem CID 14018635) has the molecular formula C12H23NO and a molecular weight of 197.32 g/mol. Its IUPAC name is 2-ethoxy-1-azacycloundecene.

Molecular Properties

Compound Name2-ethoxy-1-azacycloundecene
PubChem CID14018635
Molecular FormulaC12H23NO
Molecular Weight197.32 g/mol
Exact Mass197.18
IUPAC Name2-ethoxy-1-azacycloundecene
SMILESCCO/C1=N/CCCCCCCCC1
InChIInChI=1S/C12H23NO/c1-2-14-12-10-8-6-4-3-5-7-9-11-13-12/h2-11H2,1H3/b13-12+
InChIKeyLOGDBICYMOBJJN-OUKQBFOZSA-N
XLogP3.56
TPSA21.59 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.32
LogP ≤ 53.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-1-azacycloundecene?
The IUPAC name of 2-ethoxy-1-azacycloundecene (CID 14018635) is 2-ethoxy-1-azacycloundecene.
What is the SMILES notation for 2-ethoxy-1-azacycloundecene?
The canonical SMILES for 2-ethoxy-1-azacycloundecene is CCO/C1=N/CCCCCCCCC1.
What is the InChIKey of 2-ethoxy-1-azacycloundecene?
The InChIKey is LOGDBICYMOBJJN-OUKQBFOZSA-N. The full InChI is InChI=1S/C12H23NO/c1-2-14-12-10-8-6-4-3-5-7-9-11-13-12/h2-11H2,1H3/b13-12+.
What are the key properties of 2-ethoxy-1-azacycloundecene?
2-ethoxy-1-azacycloundecene has a molecular weight of 197.32 g/mol, XLogP of 3.56, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-1-azacycloundecene is sourced from PubChem (CID 14018635), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).