2-methyl-3-(2-methylbutan-2-yloxy)pentan-2-ol

C11H24O2 — CID 19082735

IUPAC2-methyl-3-(2-methylbutan-2-yloxy)pentan-2-ol
SMILESCCC(OC(C)(C)CC)C(C)(C)O
InChIInChI=1S/C11H24O2/c1-7-9(11(5,6)12)13-10(3,4)8-2/h9,12H,7-8H2,1-6H3
InChIKeyPOVZBBWKRSTMGF-UHFFFAOYSA-N
MW188.31 g/mol
LogP2.74
Rot. Bonds5

About 2-methyl-3-(2-methylbutan-2-yloxy)pentan-2-ol

2-methyl-3-(2-methylbutan-2-yloxy)pentan-2-ol (PubChem CID 19082735) has the molecular formula C11H24O2 and a molecular weight of 188.31 g/mol. Its IUPAC name is 2-methyl-3-(2-methylbutan-2-yloxy)pentan-2-ol.

Molecular Properties

Compound Name2-methyl-3-(2-methylbutan-2-yloxy)pentan-2-ol
PubChem CID19082735
Molecular FormulaC11H24O2
Molecular Weight188.31 g/mol
Exact Mass188.18
IUPAC Name2-methyl-3-(2-methylbutan-2-yloxy)pentan-2-ol
SMILESCCC(OC(C)(C)CC)C(C)(C)O
InChIInChI=1S/C11H24O2/c1-7-9(11(5,6)12)13-10(3,4)8-2/h9,12H,7-8H2,1-6H3
InChIKeyPOVZBBWKRSTMGF-UHFFFAOYSA-N
XLogP2.74
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.31
LogP ≤ 52.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-3-(2-methylbutan-2-yloxy)pentan-2-ol?
The IUPAC name of 2-methyl-3-(2-methylbutan-2-yloxy)pentan-2-ol (CID 19082735) is 2-methyl-3-(2-methylbutan-2-yloxy)pentan-2-ol.
What is the SMILES notation for 2-methyl-3-(2-methylbutan-2-yloxy)pentan-2-ol?
The canonical SMILES for 2-methyl-3-(2-methylbutan-2-yloxy)pentan-2-ol is CCC(OC(C)(C)CC)C(C)(C)O.
What is the InChIKey of 2-methyl-3-(2-methylbutan-2-yloxy)pentan-2-ol?
The InChIKey is POVZBBWKRSTMGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24O2/c1-7-9(11(5,6)12)13-10(3,4)8-2/h9,12H,7-8H2,1-6H3.
What are the key properties of 2-methyl-3-(2-methylbutan-2-yloxy)pentan-2-ol?
2-methyl-3-(2-methylbutan-2-yloxy)pentan-2-ol has a molecular weight of 188.31 g/mol, XLogP of 2.74, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-3-(2-methylbutan-2-yloxy)pentan-2-ol is sourced from PubChem (CID 19082735), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).