2-(5-ethyl-5-methyloxolan-2-yl)propan-2-ol

C10H20O2 — CID 5317140

IUPAC2-(5-ethyl-5-methyloxolan-2-yl)propan-2-ol
SMILESCCC1(C)CCC(C(C)(C)O)O1
InChIInChI=1S/C10H20O2/c1-5-10(4)7-6-8(12-10)9(2,3)11/h8,11H,5-7H2,1-4H3
InChIKeyZSIHHIBGUWREKL-UHFFFAOYSA-N
MW172.27 g/mol
LogP2.11
Rot. Bonds2

About 2-(5-ethyl-5-methyloxolan-2-yl)propan-2-ol

2-(5-ethyl-5-methyloxolan-2-yl)propan-2-ol (PubChem CID 5317140) has the molecular formula C10H20O2 and a molecular weight of 172.27 g/mol. Its IUPAC name is 2-(5-ethyl-5-methyloxolan-2-yl)propan-2-ol.

Molecular Properties

Compound Name2-(5-ethyl-5-methyloxolan-2-yl)propan-2-ol
PubChem CID5317140
Molecular FormulaC10H20O2
Molecular Weight172.27 g/mol
Exact Mass172.15
IUPAC Name2-(5-ethyl-5-methyloxolan-2-yl)propan-2-ol
SMILESCCC1(C)CCC(C(C)(C)O)O1
InChIInChI=1S/C10H20O2/c1-5-10(4)7-6-8(12-10)9(2,3)11/h8,11H,5-7H2,1-4H3
InChIKeyZSIHHIBGUWREKL-UHFFFAOYSA-N
XLogP2.11
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.27
LogP ≤ 52.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1,4-Anhydro-2,5-dideoxy-1-ethyl-1-propylpentitol
CID 23197
2,5,5-Triethyloxolan-3-ol
CID 34726
3-Furanol, tetrahydro-2-butyl-5,5-dimethyl-
CID 34727
1,4-Anhydro-3,5-dideoxy-4-ethyl-1-propylpentitol
CID 34728
1,4-Anhydro-3,5-dideoxy-1-ethyl-4-propylpentitol
CID 34729
1,4-Anhydro-2,5-dideoxy-1,4-diethylpentitol
CID 34720
2-(5-Methyl-5-(oxiran-2-yl)-tetrahydrofuran-2-yl)propan-1-ol
CID 91264076
2-(1-Hydroxy-1-methylethyl)-5-methyltetrahydrofuran
CID 13346424
2-[(2R,5S)-5-methyloxolan-2-yl]propan-2-ol
CID 10909691
5-Ethenyl-alpha,alpha,5-trimethyl-2-furanmethanol, tetrahydro
CID 13616671
1,4-Anhydro-2,5-dideoxy-1-methyl-1-propylpentitol
CID 23196
3-Furanol, tetrahydro-5-isobutyl-5-methyl-
CID 34708

Frequently Asked Questions

What is the IUPAC name of 2-(5-ethyl-5-methyloxolan-2-yl)propan-2-ol?
The IUPAC name of 2-(5-ethyl-5-methyloxolan-2-yl)propan-2-ol (CID 5317140) is 2-(5-ethyl-5-methyloxolan-2-yl)propan-2-ol.
What is the SMILES notation for 2-(5-ethyl-5-methyloxolan-2-yl)propan-2-ol?
The canonical SMILES for 2-(5-ethyl-5-methyloxolan-2-yl)propan-2-ol is CCC1(C)CCC(C(C)(C)O)O1.
What is the InChIKey of 2-(5-ethyl-5-methyloxolan-2-yl)propan-2-ol?
The InChIKey is ZSIHHIBGUWREKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20O2/c1-5-10(4)7-6-8(12-10)9(2,3)11/h8,11H,5-7H2,1-4H3.
What are the key properties of 2-(5-ethyl-5-methyloxolan-2-yl)propan-2-ol?
2-(5-ethyl-5-methyloxolan-2-yl)propan-2-ol has a molecular weight of 172.27 g/mol, XLogP of 2.11, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-ethyl-5-methyloxolan-2-yl)propan-2-ol is sourced from PubChem (CID 5317140), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).