1-(2,2-dimethylpentoxy)-1-ethylcyclopentane

C14H28O — CID 144690615

IUPAC1-(2,2-dimethylpentoxy)-1-ethylcyclopentane
SMILESCCCC(C)(C)COC1(CC)CCCC1
InChIInChI=1S/C14H28O/c1-5-9-13(3,4)12-15-14(6-2)10-7-8-11-14/h5-12H2,1-4H3
InChIKeyOHKRCQMYNWPRQF-UHFFFAOYSA-N
MW212.38 g/mol
LogP4.55
Rot. Bonds6

About 1-(2,2-dimethylpentoxy)-1-ethylcyclopentane

1-(2,2-dimethylpentoxy)-1-ethylcyclopentane (PubChem CID 144690615) has the molecular formula C14H28O and a molecular weight of 212.38 g/mol. Its IUPAC name is 1-(2,2-dimethylpentoxy)-1-ethylcyclopentane.

Molecular Properties

Compound Name1-(2,2-dimethylpentoxy)-1-ethylcyclopentane
PubChem CID144690615
Molecular FormulaC14H28O
Molecular Weight212.38 g/mol
Exact Mass212.21
IUPAC Name1-(2,2-dimethylpentoxy)-1-ethylcyclopentane
SMILESCCCC(C)(C)COC1(CC)CCCC1
InChIInChI=1S/C14H28O/c1-5-9-13(3,4)12-15-14(6-2)10-7-8-11-14/h5-12H2,1-4H3
InChIKeyOHKRCQMYNWPRQF-UHFFFAOYSA-N
XLogP4.55
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.38
LogP ≤ 54.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1-(2,2-dimethylbutoxy)-1-ethylcyclopentane
CID 88993752
1-(2-tert-butyl-2,4-dimethylpentoxy)-1-ethylcyclooctane
CID 123823776
(1-ethylcyclopentyl) 2-methyl-2-propan-2-ylpentanoate
CID 70649113
1-methoxy-2,2-dimethylpentane
CID 57120820
2,2-dimethylpentyl cyanate
CID 87579409
2-methyl-N-[(1-propoxycyclopentyl)methyl]propan-2-amine
CID 62107466
1-ethyl-1-methoxycyclohexane
CID 21039859
1-ethyl-1-propoxycyclopropane
CID 59107418
N-[[1-(3,3-dimethylbutoxy)cyclopentyl]methyl]ethanamine
CID 66226009
N-[(1-propoxycyclopentyl)methyl]propan-2-amine
CID 62107292
2-[(1-ethylcyclohexyl)oxymethyl]oxirane
CID 19817909
1-(3,3-dimethylpent-1-en-2-yloxy)-1-ethylcyclopentane
CID 66804245

Frequently Asked Questions

What is the IUPAC name of 1-(2,2-dimethylpentoxy)-1-ethylcyclopentane?
The IUPAC name of 1-(2,2-dimethylpentoxy)-1-ethylcyclopentane (CID 144690615) is 1-(2,2-dimethylpentoxy)-1-ethylcyclopentane.
What is the SMILES notation for 1-(2,2-dimethylpentoxy)-1-ethylcyclopentane?
The canonical SMILES for 1-(2,2-dimethylpentoxy)-1-ethylcyclopentane is CCCC(C)(C)COC1(CC)CCCC1.
What is the InChIKey of 1-(2,2-dimethylpentoxy)-1-ethylcyclopentane?
The InChIKey is OHKRCQMYNWPRQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28O/c1-5-9-13(3,4)12-15-14(6-2)10-7-8-11-14/h5-12H2,1-4H3.
What are the key properties of 1-(2,2-dimethylpentoxy)-1-ethylcyclopentane?
1-(2,2-dimethylpentoxy)-1-ethylcyclopentane has a molecular weight of 212.38 g/mol, XLogP of 4.55, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,2-dimethylpentoxy)-1-ethylcyclopentane is sourced from PubChem (CID 144690615), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).