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

C10H20O2 — CID 141096935

IUPAC2-methoxy-3-(1-methoxyethyl)-4-methylpent-2-ene
SMILESCOC(C)=C(C(C)C)C(C)OC
InChIInChI=1S/C10H20O2/c1-7(2)10(8(3)11-5)9(4)12-6/h7-8H,1-6H3
InChIKeyNXWFSKGKASXNTG-UHFFFAOYSA-N
MW172.27 g/mol
LogP2.60
Rot. Bonds4

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

2-methoxy-3-(1-methoxyethyl)-4-methylpent-2-ene (PubChem CID 141096935) has the molecular formula C10H20O2 and a molecular weight of 172.27 g/mol. Its IUPAC name is 2-methoxy-3-(1-methoxyethyl)-4-methylpent-2-ene.

Molecular Properties

Compound Name2-methoxy-3-(1-methoxyethyl)-4-methylpent-2-ene
PubChem CID141096935
Molecular FormulaC10H20O2
Molecular Weight172.27 g/mol
Exact Mass172.15
IUPAC Name2-methoxy-3-(1-methoxyethyl)-4-methylpent-2-ene
SMILESCOC(C)=C(C(C)C)C(C)OC
InChIInChI=1S/C10H20O2/c1-7(2)10(8(3)11-5)9(4)12-6/h7-8H,1-6H3
InChIKeyNXWFSKGKASXNTG-UHFFFAOYSA-N
XLogP2.60
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.27
LogP ≤ 52.60
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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Frequently Asked Questions

What is the IUPAC name of 2-methoxy-3-(1-methoxyethyl)-4-methylpent-2-ene?
The IUPAC name of 2-methoxy-3-(1-methoxyethyl)-4-methylpent-2-ene (CID 141096935) is 2-methoxy-3-(1-methoxyethyl)-4-methylpent-2-ene.
What is the SMILES notation for 2-methoxy-3-(1-methoxyethyl)-4-methylpent-2-ene?
The canonical SMILES for 2-methoxy-3-(1-methoxyethyl)-4-methylpent-2-ene is COC(C)=C(C(C)C)C(C)OC.
What is the InChIKey of 2-methoxy-3-(1-methoxyethyl)-4-methylpent-2-ene?
The InChIKey is NXWFSKGKASXNTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20O2/c1-7(2)10(8(3)11-5)9(4)12-6/h7-8H,1-6H3.
What are the key properties of 2-methoxy-3-(1-methoxyethyl)-4-methylpent-2-ene?
2-methoxy-3-(1-methoxyethyl)-4-methylpent-2-ene has a molecular weight of 172.27 g/mol, XLogP of 2.60, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-3-(1-methoxyethyl)-4-methylpent-2-ene is sourced from PubChem (CID 141096935), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).