2-cyclopropyl-5-(2-methoxyethoxy)-2-methylpentan-1-ol

C12H24O3 — CID 103415301

IUPAC2-cyclopropyl-5-(2-methoxyethoxy)-2-methylpentan-1-ol
SMILESCOCCOCCCC(C)(CO)C1CC1
InChIInChI=1S/C12H24O3/c1-12(10-13,11-4-5-11)6-3-7-15-9-8-14-2/h11,13H,3-10H2,1-2H3
InChIKeyXVQGUMPUGXPPFB-UHFFFAOYSA-N
MW216.32 g/mol
LogP1.84
Rot. Bonds9

About 2-cyclopropyl-5-(2-methoxyethoxy)-2-methylpentan-1-ol

2-cyclopropyl-5-(2-methoxyethoxy)-2-methylpentan-1-ol (PubChem CID 103415301) has the molecular formula C12H24O3 and a molecular weight of 216.32 g/mol. Its IUPAC name is 2-cyclopropyl-5-(2-methoxyethoxy)-2-methylpentan-1-ol.

Molecular Properties

Compound Name2-cyclopropyl-5-(2-methoxyethoxy)-2-methylpentan-1-ol
PubChem CID103415301
Molecular FormulaC12H24O3
Molecular Weight216.32 g/mol
Exact Mass216.17
IUPAC Name2-cyclopropyl-5-(2-methoxyethoxy)-2-methylpentan-1-ol
SMILESCOCCOCCCC(C)(CO)C1CC1
InChIInChI=1S/C12H24O3/c1-12(10-13,11-4-5-11)6-3-7-15-9-8-14-2/h11,13H,3-10H2,1-2H3
InChIKeyXVQGUMPUGXPPFB-UHFFFAOYSA-N
XLogP1.84
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.32
LogP ≤ 51.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

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{5-Oxaspiro[2.5]octan-1-yl}methanol
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3-[(1R,2R)-2-(butoxymethyl)-1-methylcyclopropyl]propan-1-ol
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CID 84064866
4-Methyl-5-[4-(1,2,2-trimethylcyclopropyl)butoxy]pentan-1-ol
CID 124012046
1-Dispiro[2.0.24.13]heptan-7-yl-2-propan-2-yloxyethanol
CID 153422472
[2-(2-Methoxyethyl)-2-methylcyclopropyl]methanol
CID 81357365
[2-(2-Methoxy-2-methylpropyl)-2-methylcyclopropyl]methanol
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7-Oxaspiro[2.6]nonan-2-ylmethanol
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[2-Cyclopropyl-2-(methoxymethyl)cyclopropyl]methanol
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Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-5-(2-methoxyethoxy)-2-methylpentan-1-ol?
The IUPAC name of 2-cyclopropyl-5-(2-methoxyethoxy)-2-methylpentan-1-ol (CID 103415301) is 2-cyclopropyl-5-(2-methoxyethoxy)-2-methylpentan-1-ol.
What is the SMILES notation for 2-cyclopropyl-5-(2-methoxyethoxy)-2-methylpentan-1-ol?
The canonical SMILES for 2-cyclopropyl-5-(2-methoxyethoxy)-2-methylpentan-1-ol is COCCOCCCC(C)(CO)C1CC1.
What is the InChIKey of 2-cyclopropyl-5-(2-methoxyethoxy)-2-methylpentan-1-ol?
The InChIKey is XVQGUMPUGXPPFB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24O3/c1-12(10-13,11-4-5-11)6-3-7-15-9-8-14-2/h11,13H,3-10H2,1-2H3.
What are the key properties of 2-cyclopropyl-5-(2-methoxyethoxy)-2-methylpentan-1-ol?
2-cyclopropyl-5-(2-methoxyethoxy)-2-methylpentan-1-ol has a molecular weight of 216.32 g/mol, XLogP of 1.84, 9 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-5-(2-methoxyethoxy)-2-methylpentan-1-ol is sourced from PubChem (CID 103415301), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).