1-[2-[(2-methylpropan-2-yl)oxy]ethoxy]pent-2-yne

C11H20O2 — CID 164933181

IUPAC1-[2-[(2-methylpropan-2-yl)oxy]ethoxy]pent-2-yne
SMILESCCC#CCOCCOC(C)(C)C
InChIInChI=1S/C11H20O2/c1-5-6-7-8-12-9-10-13-11(2,3)4/h5,8-10H2,1-4H3
InChIKeyFOAVJYAXMMMNNZ-UHFFFAOYSA-N
MW184.28 g/mol
LogP2.23
Rot. Bonds4

About 1-[2-[(2-methylpropan-2-yl)oxy]ethoxy]pent-2-yne

1-[2-[(2-methylpropan-2-yl)oxy]ethoxy]pent-2-yne (PubChem CID 164933181) has the molecular formula C11H20O2 and a molecular weight of 184.28 g/mol. Its IUPAC name is 1-[2-[(2-methylpropan-2-yl)oxy]ethoxy]pent-2-yne.

Molecular Properties

Compound Name1-[2-[(2-methylpropan-2-yl)oxy]ethoxy]pent-2-yne
PubChem CID164933181
Molecular FormulaC11H20O2
Molecular Weight184.28 g/mol
Exact Mass184.15
IUPAC Name1-[2-[(2-methylpropan-2-yl)oxy]ethoxy]pent-2-yne
SMILESCCC#CCOCCOC(C)(C)C
InChIInChI=1S/C11H20O2/c1-5-6-7-8-12-9-10-13-11(2,3)4/h5,8-10H2,1-4H3
InChIKeyFOAVJYAXMMMNNZ-UHFFFAOYSA-N
XLogP2.23
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.28
LogP ≤ 52.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'triple_bond', 'substructure': 'N/A'}

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Related Compounds

2-methyl-2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]propane
CID 134597159
2-methyl-2-[2-(2-propoxyethoxy)ethoxy]propane
CID 87735391
2,2-dimethyl-1-[2-[2-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethoxy]ethoxy]ethoxy]propane
CID 134553502
2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]-2-methylpropane
CID 134553507
1,3-bis[2-[(2-methylpropan-2-yl)oxy]ethoxy]-2,2-bis[2-[(2-methylpropan-2-yl)oxy]ethoxymethyl]propane
CID 122607174
1-[4-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethoxy]butoxy]-4-propoxybutane
CID 134553508
1-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethoxy]hexane
CID 164583744
2-[2-[2-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol
CID 19871026
3,3-dimethyl-1-[2-[2-[2-[2-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]butane
CID 153436884
2-methyl-1-[2-[(2-methylpropan-2-yl)oxy]ethoxy]propan-2-ol
CID 123858699
4,4-dimethyl-1-[1-[2-[(2-methylpropan-2-yl)oxy]ethoxy]propan-2-yloxy]pent-2-yne
CID 165380005
1-bromo-2-methyl-3-[2-[(2-methylpropan-2-yl)oxy]ethoxy]propane
CID 112587518

Frequently Asked Questions

What is the IUPAC name of 1-[2-[(2-methylpropan-2-yl)oxy]ethoxy]pent-2-yne?
The IUPAC name of 1-[2-[(2-methylpropan-2-yl)oxy]ethoxy]pent-2-yne (CID 164933181) is 1-[2-[(2-methylpropan-2-yl)oxy]ethoxy]pent-2-yne.
What is the SMILES notation for 1-[2-[(2-methylpropan-2-yl)oxy]ethoxy]pent-2-yne?
The canonical SMILES for 1-[2-[(2-methylpropan-2-yl)oxy]ethoxy]pent-2-yne is CCC#CCOCCOC(C)(C)C.
What is the InChIKey of 1-[2-[(2-methylpropan-2-yl)oxy]ethoxy]pent-2-yne?
The InChIKey is FOAVJYAXMMMNNZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20O2/c1-5-6-7-8-12-9-10-13-11(2,3)4/h5,8-10H2,1-4H3.
What are the key properties of 1-[2-[(2-methylpropan-2-yl)oxy]ethoxy]pent-2-yne?
1-[2-[(2-methylpropan-2-yl)oxy]ethoxy]pent-2-yne has a molecular weight of 184.28 g/mol, XLogP of 2.23, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[(2-methylpropan-2-yl)oxy]ethoxy]pent-2-yne is sourced from PubChem (CID 164933181), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).