1-(ethoxymethyl)-2H-azete

C6H11NO — CID 23545571

IUPAC1-(ethoxymethyl)-2H-azete
SMILESCCOCN1C=CC1
InChIInChI=1S/C6H11NO/c1-2-8-6-7-4-3-5-7/h3-4H,2,5-6H2,1H3
InChIKeySNFVBOFTJVZZQE-UHFFFAOYSA-N
MW113.16 g/mol
LogP0.81
Rot. Bonds3

About 1-(ethoxymethyl)-2H-azete

1-(ethoxymethyl)-2H-azete (PubChem CID 23545571) has the molecular formula C6H11NO and a molecular weight of 113.16 g/mol. Its IUPAC name is 1-(ethoxymethyl)-2H-azete.

Molecular Properties

Compound Name1-(ethoxymethyl)-2H-azete
PubChem CID23545571
Molecular FormulaC6H11NO
Molecular Weight113.16 g/mol
Exact Mass113.08
IUPAC Name1-(ethoxymethyl)-2H-azete
SMILESCCOCN1C=CC1
InChIInChI=1S/C6H11NO/c1-2-8-6-7-4-3-5-7/h3-4H,2,5-6H2,1H3
InChIKeySNFVBOFTJVZZQE-UHFFFAOYSA-N
XLogP0.81
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500113.16
LogP ≤ 50.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(ethoxymethyl)-2H-azete?
The IUPAC name of 1-(ethoxymethyl)-2H-azete (CID 23545571) is 1-(ethoxymethyl)-2H-azete.
What is the SMILES notation for 1-(ethoxymethyl)-2H-azete?
The canonical SMILES for 1-(ethoxymethyl)-2H-azete is CCOCN1C=CC1.
What is the InChIKey of 1-(ethoxymethyl)-2H-azete?
The InChIKey is SNFVBOFTJVZZQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11NO/c1-2-8-6-7-4-3-5-7/h3-4H,2,5-6H2,1H3.
What are the key properties of 1-(ethoxymethyl)-2H-azete?
1-(ethoxymethyl)-2H-azete has a molecular weight of 113.16 g/mol, XLogP of 0.81, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(ethoxymethyl)-2H-azete is sourced from PubChem (CID 23545571), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).