2-ethoxy-5-methyl-3,4-dihydro-2H-pyran

C8H14O2 — CID 12610305

IUPAC2-ethoxy-5-methyl-3,4-dihydro-2H-pyran
SMILESCCOC1CCC(C)=CO1
InChIInChI=1S/C8H14O2/c1-3-9-8-5-4-7(2)6-10-8/h6,8H,3-5H2,1-2H3
InChIKeyMRNFIMQXVANEFK-UHFFFAOYSA-N
MW142.20 g/mol
LogP2.06
Rot. Bonds2

About 2-ethoxy-5-methyl-3,4-dihydro-2H-pyran

2-ethoxy-5-methyl-3,4-dihydro-2H-pyran (PubChem CID 12610305) has the molecular formula C8H14O2 and a molecular weight of 142.20 g/mol. Its IUPAC name is 2-ethoxy-5-methyl-3,4-dihydro-2H-pyran.

Molecular Properties

Compound Name2-ethoxy-5-methyl-3,4-dihydro-2H-pyran
PubChem CID12610305
Molecular FormulaC8H14O2
Molecular Weight142.20 g/mol
Exact Mass142.10
IUPAC Name2-ethoxy-5-methyl-3,4-dihydro-2H-pyran
SMILESCCOC1CCC(C)=CO1
InChIInChI=1S/C8H14O2/c1-3-9-8-5-4-7(2)6-10-8/h6,8H,3-5H2,1-2H3
InChIKeyMRNFIMQXVANEFK-UHFFFAOYSA-N
XLogP2.06
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.20
LogP ≤ 52.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-5-methyl-3,4-dihydro-2H-pyran?
The IUPAC name of 2-ethoxy-5-methyl-3,4-dihydro-2H-pyran (CID 12610305) is 2-ethoxy-5-methyl-3,4-dihydro-2H-pyran.
What is the SMILES notation for 2-ethoxy-5-methyl-3,4-dihydro-2H-pyran?
The canonical SMILES for 2-ethoxy-5-methyl-3,4-dihydro-2H-pyran is CCOC1CCC(C)=CO1.
What is the InChIKey of 2-ethoxy-5-methyl-3,4-dihydro-2H-pyran?
The InChIKey is MRNFIMQXVANEFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14O2/c1-3-9-8-5-4-7(2)6-10-8/h6,8H,3-5H2,1-2H3.
What are the key properties of 2-ethoxy-5-methyl-3,4-dihydro-2H-pyran?
2-ethoxy-5-methyl-3,4-dihydro-2H-pyran has a molecular weight of 142.20 g/mol, XLogP of 2.06, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-5-methyl-3,4-dihydro-2H-pyran is sourced from PubChem (CID 12610305), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).