2-ethoxy-3-(1-methoxyethyl)-4-methylpent-2-ene

C11H22O2 — CID 141096912

IUPAC2-ethoxy-3-(1-methoxyethyl)-4-methylpent-2-ene
SMILESCCOC(C)=C(C(C)C)C(C)OC
InChIInChI=1S/C11H22O2/c1-7-13-10(5)11(8(2)3)9(4)12-6/h8-9H,7H2,1-6H3
InChIKeyNTKWZDCOVAXHRS-UHFFFAOYSA-N
MW186.29 g/mol
LogP2.99
Rot. Bonds5

About 2-ethoxy-3-(1-methoxyethyl)-4-methylpent-2-ene

2-ethoxy-3-(1-methoxyethyl)-4-methylpent-2-ene (PubChem CID 141096912) has the molecular formula C11H22O2 and a molecular weight of 186.29 g/mol. Its IUPAC name is 2-ethoxy-3-(1-methoxyethyl)-4-methylpent-2-ene.

Molecular Properties

Compound Name2-ethoxy-3-(1-methoxyethyl)-4-methylpent-2-ene
PubChem CID141096912
Molecular FormulaC11H22O2
Molecular Weight186.29 g/mol
Exact Mass186.16
IUPAC Name2-ethoxy-3-(1-methoxyethyl)-4-methylpent-2-ene
SMILESCCOC(C)=C(C(C)C)C(C)OC
InChIInChI=1S/C11H22O2/c1-7-13-10(5)11(8(2)3)9(4)12-6/h8-9H,7H2,1-6H3
InChIKeyNTKWZDCOVAXHRS-UHFFFAOYSA-N
XLogP2.99
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.29
LogP ≤ 52.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}

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Related Compounds

5-ethoxy-2-ethyl-3,4-dimethyl-3,6-dihydro-2H-pyran
CID 19915124
4-Methoxy-2,3,5-trimethylhex-2-ene
CID 23385074
(4R)-4-methoxy-2,3,5-trimethylhex-2-ene
CID 59039384
2,4-Dimethoxy-3-methylpent-2-ene
CID 91050234
2,4-Dimethoxy-3-methylhex-2-ene
CID 91148659
2,5-Dimethyl-3,4-di(propan-2-yl)-2,5-dihydrofuran
CID 135194506
(2R,5R)-2,5-dimethyl-3,4-di(propan-2-yl)-2,5-dihydrofuran
CID 135194508
(2R,5S)-2,5-dimethyl-3,4-di(propan-2-yl)-2,5-dihydrofuran
CID 135194509
(2S,5S)-2,5-dimethyl-3,4-di(propan-2-yl)-2,5-dihydrofuran
CID 135194511
5,5-dimethyl-3,4-di(propan-2-yl)-2H-furan
CID 140883777
2-Ethoxy-3-(1-methoxyethyl)-5-methylhex-2-ene
CID 141096911
2-Methoxy-3-(1-methoxyethyl)-5-methylhex-2-ene
CID 141096934

Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-3-(1-methoxyethyl)-4-methylpent-2-ene?
The IUPAC name of 2-ethoxy-3-(1-methoxyethyl)-4-methylpent-2-ene (CID 141096912) is 2-ethoxy-3-(1-methoxyethyl)-4-methylpent-2-ene.
What is the SMILES notation for 2-ethoxy-3-(1-methoxyethyl)-4-methylpent-2-ene?
The canonical SMILES for 2-ethoxy-3-(1-methoxyethyl)-4-methylpent-2-ene is CCOC(C)=C(C(C)C)C(C)OC.
What is the InChIKey of 2-ethoxy-3-(1-methoxyethyl)-4-methylpent-2-ene?
The InChIKey is NTKWZDCOVAXHRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22O2/c1-7-13-10(5)11(8(2)3)9(4)12-6/h8-9H,7H2,1-6H3.
What are the key properties of 2-ethoxy-3-(1-methoxyethyl)-4-methylpent-2-ene?
2-ethoxy-3-(1-methoxyethyl)-4-methylpent-2-ene has a molecular weight of 186.29 g/mol, XLogP of 2.99, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-3-(1-methoxyethyl)-4-methylpent-2-ene is sourced from PubChem (CID 141096912), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).