5-(1-methoxyethyl)-5-(methoxymethyl)-1,2,3,4-tetramethylcyclopenta-1,3-diene

C14H24O2 — CID 22140459

IUPAC5-(1-methoxyethyl)-5-(methoxymethyl)-1,2,3,4-tetramethylcyclopenta-1,3-diene
SMILESCOCC1(C(C)OC)C(C)=C(C)C(C)=C1C
InChIInChI=1S/C14H24O2/c1-9-10(2)12(4)14(8-15-6,11(9)3)13(5)16-7/h13H,8H2,1-7H3
InChIKeyYFBQIUNHGZYHKD-UHFFFAOYSA-N
MW224.34 g/mol
LogP3.34
Rot. Bonds4

About 5-(1-methoxyethyl)-5-(methoxymethyl)-1,2,3,4-tetramethylcyclopenta-1,3-diene

5-(1-methoxyethyl)-5-(methoxymethyl)-1,2,3,4-tetramethylcyclopenta-1,3-diene (PubChem CID 22140459) has the molecular formula C14H24O2 and a molecular weight of 224.34 g/mol. Its IUPAC name is 5-(1-methoxyethyl)-5-(methoxymethyl)-1,2,3,4-tetramethylcyclopenta-1,3-diene.

Molecular Properties

Compound Name5-(1-methoxyethyl)-5-(methoxymethyl)-1,2,3,4-tetramethylcyclopenta-1,3-diene
PubChem CID22140459
Molecular FormulaC14H24O2
Molecular Weight224.34 g/mol
Exact Mass224.18
IUPAC Name5-(1-methoxyethyl)-5-(methoxymethyl)-1,2,3,4-tetramethylcyclopenta-1,3-diene
SMILESCOCC1(C(C)OC)C(C)=C(C)C(C)=C1C
InChIInChI=1S/C14H24O2/c1-9-10(2)12(4)14(8-15-6,11(9)3)13(5)16-7/h13H,8H2,1-7H3
InChIKeyYFBQIUNHGZYHKD-UHFFFAOYSA-N
XLogP3.34
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.34
LogP ≤ 53.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-(1-methoxyethyl)-5-(methoxymethyl)-1,2,3,4-tetramethylcyclopenta-1,3-diene?
The IUPAC name of 5-(1-methoxyethyl)-5-(methoxymethyl)-1,2,3,4-tetramethylcyclopenta-1,3-diene (CID 22140459) is 5-(1-methoxyethyl)-5-(methoxymethyl)-1,2,3,4-tetramethylcyclopenta-1,3-diene.
What is the SMILES notation for 5-(1-methoxyethyl)-5-(methoxymethyl)-1,2,3,4-tetramethylcyclopenta-1,3-diene?
The canonical SMILES for 5-(1-methoxyethyl)-5-(methoxymethyl)-1,2,3,4-tetramethylcyclopenta-1,3-diene is COCC1(C(C)OC)C(C)=C(C)C(C)=C1C.
What is the InChIKey of 5-(1-methoxyethyl)-5-(methoxymethyl)-1,2,3,4-tetramethylcyclopenta-1,3-diene?
The InChIKey is YFBQIUNHGZYHKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24O2/c1-9-10(2)12(4)14(8-15-6,11(9)3)13(5)16-7/h13H,8H2,1-7H3.
What are the key properties of 5-(1-methoxyethyl)-5-(methoxymethyl)-1,2,3,4-tetramethylcyclopenta-1,3-diene?
5-(1-methoxyethyl)-5-(methoxymethyl)-1,2,3,4-tetramethylcyclopenta-1,3-diene has a molecular weight of 224.34 g/mol, XLogP of 3.34, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(1-methoxyethyl)-5-(methoxymethyl)-1,2,3,4-tetramethylcyclopenta-1,3-diene is sourced from PubChem (CID 22140459), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).