3-ethyl-3-methoxy-2-methylpentane

C9H20O — CID 23384914

IUPAC3-ethyl-3-methoxy-2-methylpentane
SMILESCCC(CC)(OC)C(C)C
InChIInChI=1S/C9H20O/c1-6-9(7-2,10-5)8(3)4/h8H,6-7H2,1-5H3
InChIKeyLCIWLDABLLYDFK-UHFFFAOYSA-N
MW144.26 g/mol
LogP2.85
Rot. Bonds4

About 3-ethyl-3-methoxy-2-methylpentane

3-ethyl-3-methoxy-2-methylpentane (PubChem CID 23384914) has the molecular formula C9H20O and a molecular weight of 144.26 g/mol. Its IUPAC name is 3-ethyl-3-methoxy-2-methylpentane.

Molecular Properties

Compound Name3-ethyl-3-methoxy-2-methylpentane
PubChem CID23384914
Molecular FormulaC9H20O
Molecular Weight144.26 g/mol
Exact Mass144.15
IUPAC Name3-ethyl-3-methoxy-2-methylpentane
SMILESCCC(CC)(OC)C(C)C
InChIInChI=1S/C9H20O/c1-6-9(7-2,10-5)8(3)4/h8H,6-7H2,1-5H3
InChIKeyLCIWLDABLLYDFK-UHFFFAOYSA-N
XLogP2.85
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.26
LogP ≤ 52.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

5-ethyl-5-methoxy-6-methylhept-1-ene
CID 23385160
3-ethyl-3-methoxy-2,4-dimethylpentane
CID 23384912
3-ethyl-3-methoxy-4-propylheptane
CID 144783113
2,2-dimethoxy-3-methylbutan-1-ol
CID 57218658
3,3-dimethoxy-2,5-dimethylhexane
CID 130439483
1-bromo-2,2-dimethoxy-3-methylbutane
CID 177040835
(3R)-3-ethyl-3-methoxy-2,4-dimethylpentan-2-ol
CID 59039431
5-ethyl-5-methoxy-2-methyl-N-propylheptan-4-amine
CID 116761321
4-methoxy-4-propan-2-ylocta-1,7-diene
CID 23385043
4-ethyl-4-methoxy-2,6-dimethylheptane
CID 141423209
3,3-bis(methoxymethyl)-2-methylpentane
CID 89106557
3-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]-3-ethyl-2-methylpentane
CID 90397567

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-3-methoxy-2-methylpentane?
The IUPAC name of 3-ethyl-3-methoxy-2-methylpentane (CID 23384914) is 3-ethyl-3-methoxy-2-methylpentane.
What is the SMILES notation for 3-ethyl-3-methoxy-2-methylpentane?
The canonical SMILES for 3-ethyl-3-methoxy-2-methylpentane is CCC(CC)(OC)C(C)C.
What is the InChIKey of 3-ethyl-3-methoxy-2-methylpentane?
The InChIKey is LCIWLDABLLYDFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20O/c1-6-9(7-2,10-5)8(3)4/h8H,6-7H2,1-5H3.
What are the key properties of 3-ethyl-3-methoxy-2-methylpentane?
3-ethyl-3-methoxy-2-methylpentane has a molecular weight of 144.26 g/mol, XLogP of 2.85, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-3-methoxy-2-methylpentane is sourced from PubChem (CID 23384914), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).