3-ethyl-3-(2-methylpropoxy)pentane

C11H24O — CID 123413367

IUPAC3-ethyl-3-(2-methylpropoxy)pentane
SMILESCCC(CC)(CC)OCC(C)C
InChIInChI=1S/C11H24O/c1-6-11(7-2,8-3)12-9-10(4)5/h10H,6-9H2,1-5H3
InChIKeyVJKCHJGENMJJLD-UHFFFAOYSA-N
MW172.31 g/mol
LogP3.63
Rot. Bonds6

About 3-ethyl-3-(2-methylpropoxy)pentane

3-ethyl-3-(2-methylpropoxy)pentane (PubChem CID 123413367) has the molecular formula C11H24O and a molecular weight of 172.31 g/mol. Its IUPAC name is 3-ethyl-3-(2-methylpropoxy)pentane.

Molecular Properties

Compound Name3-ethyl-3-(2-methylpropoxy)pentane
PubChem CID123413367
Molecular FormulaC11H24O
Molecular Weight172.31 g/mol
Exact Mass172.18
IUPAC Name3-ethyl-3-(2-methylpropoxy)pentane
SMILESCCC(CC)(CC)OCC(C)C
InChIInChI=1S/C11H24O/c1-6-11(7-2,8-3)12-9-10(4)5/h10H,6-9H2,1-5H3
InChIKeyVJKCHJGENMJJLD-UHFFFAOYSA-N
XLogP3.63
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.31
LogP ≤ 53.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2-methyl-2-(2-methylpropoxy)butan-1-amine
CID 62355442
4,4-bis(2-methylpropoxy)heptane
CID 89439666
2-ethyl-2-(2-methylbutoxy)butan-1-amine
CID 65051236
3-methyl-1-(3-methylpentan-3-yloxy)-3-(2-methylpropoxy)pentane
CID 89169879
N-ethyl-2-methyl-2-(2-methylpropoxy)butan-1-amine
CID 62355640
titanium;tris(2-methylpropoxy)methanol
CID 87320459
4-ethyl-4-methoxy-2,6-dimethylheptane
CID 141423209
2,2,2-tris(2-methylpropoxy)acetonitrile
CID 13161381
alumane;2-ethyl-2-(2-methylpropoxy)-3-oxobutanoic acid
CID 175257771
1-(2-chloro-1,1,2-trifluoroethoxy)-2-methylpropane
CID 139683226
2-methyl-2-(2-methylpropoxy)propanamide
CID 137483152
2-methylpropyl 2,2-diethylbutanoate
CID 139972882

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-3-(2-methylpropoxy)pentane?
The IUPAC name of 3-ethyl-3-(2-methylpropoxy)pentane (CID 123413367) is 3-ethyl-3-(2-methylpropoxy)pentane.
What is the SMILES notation for 3-ethyl-3-(2-methylpropoxy)pentane?
The canonical SMILES for 3-ethyl-3-(2-methylpropoxy)pentane is CCC(CC)(CC)OCC(C)C.
What is the InChIKey of 3-ethyl-3-(2-methylpropoxy)pentane?
The InChIKey is VJKCHJGENMJJLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24O/c1-6-11(7-2,8-3)12-9-10(4)5/h10H,6-9H2,1-5H3.
What are the key properties of 3-ethyl-3-(2-methylpropoxy)pentane?
3-ethyl-3-(2-methylpropoxy)pentane has a molecular weight of 172.31 g/mol, XLogP of 3.63, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-3-(2-methylpropoxy)pentane is sourced from PubChem (CID 123413367), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).