1-(2-methoxyethoxymethoxy)-4-methylpentane

C10H22O3 — CID 157079781

IUPAC1-(2-methoxyethoxymethoxy)-4-methylpentane
SMILESCOCCOCOCCCC(C)C
InChIInChI=1S/C10H22O3/c1-10(2)5-4-6-12-9-13-8-7-11-3/h10H,4-9H2,1-3H3
InChIKeyZHLAQOUQUQJFQN-UHFFFAOYSA-N
MW190.28 g/mol
LogP2.06
Rot. Bonds9

About 1-(2-methoxyethoxymethoxy)-4-methylpentane

1-(2-methoxyethoxymethoxy)-4-methylpentane (PubChem CID 157079781) has the molecular formula C10H22O3 and a molecular weight of 190.28 g/mol. Its IUPAC name is 1-(2-methoxyethoxymethoxy)-4-methylpentane.

Molecular Properties

Compound Name1-(2-methoxyethoxymethoxy)-4-methylpentane
PubChem CID157079781
Molecular FormulaC10H22O3
Molecular Weight190.28 g/mol
Exact Mass190.16
IUPAC Name1-(2-methoxyethoxymethoxy)-4-methylpentane
SMILESCOCCOCOCCCC(C)C
InChIInChI=1S/C10H22O3/c1-10(2)5-4-6-12-9-13-8-7-11-3/h10H,4-9H2,1-3H3
InChIKeyZHLAQOUQUQJFQN-UHFFFAOYSA-N
XLogP2.06
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.28
LogP ≤ 52.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

1-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]-4-methylpentane
CID 58473516
1-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]-4-methylpentane;1-[2-(2-ethoxyethoxy)ethoxy]-4-methylpentane;1-(2-ethoxyethoxy)-4-methylpentane;methane;1-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]-4-methylpentane;bis(1-[2-(2-methoxyethoxy)ethoxy]-4-methylpentane);1-(2-methoxyethoxymethoxy)-4-methylpentane;1-(2-methoxyethoxy)-4-methylpentane;1-(methoxymethoxy)-4-methylpentane;1-methoxy-4-methylpentane;4-methyl-1-[2-(2-propoxyethoxy)ethoxy]pentane;4-methyl-1-(2-propoxyethoxy)pentane
CID 159796122
4-methyl-1-[2-[2-(4-methylpentoxy)ethoxy]ethoxy]pentane
CID 58371353
2-(2-methoxyethoxymethoxy)-6-methylheptane
CID 12653649
1-(methoxymethoxy)-6-methylheptane
CID 54450331
5-methyl-1-[2-(4-methylpentoxy)ethoxy]hexane
CID 157231841
1-[1,3-bis(2-methoxyethoxy)propan-2-yloxy]-4-methylpentane
CID 158254668
1-(3-methoxypropoxy)-3-methylbutane
CID 18925853
1-methoxy-4,8-dimethylnonane
CID 90974533
6-methyl-1-[2-(6-methylheptoxy)ethoxy]heptane
CID 150695983
1-(2-methoxyethoxyamino)-3-(4-methylpentoxy)propan-2-ol
CID 82723139
N-(2-methoxyethoxy)-3-methylbutan-1-amine
CID 82711034

Frequently Asked Questions

What is the IUPAC name of 1-(2-methoxyethoxymethoxy)-4-methylpentane?
The IUPAC name of 1-(2-methoxyethoxymethoxy)-4-methylpentane (CID 157079781) is 1-(2-methoxyethoxymethoxy)-4-methylpentane.
What is the SMILES notation for 1-(2-methoxyethoxymethoxy)-4-methylpentane?
The canonical SMILES for 1-(2-methoxyethoxymethoxy)-4-methylpentane is COCCOCOCCCC(C)C.
What is the InChIKey of 1-(2-methoxyethoxymethoxy)-4-methylpentane?
The InChIKey is ZHLAQOUQUQJFQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22O3/c1-10(2)5-4-6-12-9-13-8-7-11-3/h10H,4-9H2,1-3H3.
What are the key properties of 1-(2-methoxyethoxymethoxy)-4-methylpentane?
1-(2-methoxyethoxymethoxy)-4-methylpentane has a molecular weight of 190.28 g/mol, XLogP of 2.06, 9 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methoxyethoxymethoxy)-4-methylpentane is sourced from PubChem (CID 157079781), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).