(5-methyloxolan-3-yl)-(2-propan-2-yloxyphenyl)methanol

C15H22O3 — CID 115823707

IUPAC(5-methyloxolan-3-yl)-(2-propan-2-yloxyphenyl)methanol
SMILESCC(C)Oc1ccccc1C(O)C1COC(C)C1
InChIInChI=1S/C15H22O3/c1-10(2)18-14-7-5-4-6-13(14)15(16)12-8-11(3)17-9-12/h4-7,10-12,15-16H,8-9H2,1-3H3
InChIKeyHPWUBNAIAWKBDQ-UHFFFAOYSA-N
MW250.34 g/mol
LogP2.93
Rot. Bonds4

About (5-methyloxolan-3-yl)-(2-propan-2-yloxyphenyl)methanol

(5-methyloxolan-3-yl)-(2-propan-2-yloxyphenyl)methanol (PubChem CID 115823707) has the molecular formula C15H22O3 and a molecular weight of 250.34 g/mol. Its IUPAC name is (5-methyloxolan-3-yl)-(2-propan-2-yloxyphenyl)methanol.

Molecular Properties

Compound Name(5-methyloxolan-3-yl)-(2-propan-2-yloxyphenyl)methanol
PubChem CID115823707
Molecular FormulaC15H22O3
Molecular Weight250.34 g/mol
Exact Mass250.16
IUPAC Name(5-methyloxolan-3-yl)-(2-propan-2-yloxyphenyl)methanol
SMILESCC(C)Oc1ccccc1C(O)C1COC(C)C1
InChIInChI=1S/C15H22O3/c1-10(2)18-14-7-5-4-6-13(14)15(16)12-8-11(3)17-9-12/h4-7,10-12,15-16H,8-9H2,1-3H3
InChIKeyHPWUBNAIAWKBDQ-UHFFFAOYSA-N
XLogP2.93
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.34
LogP ≤ 52.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(5-methyloxolan-3-yl)-(2-propan-2-yloxyphenyl)methyl]propan-1-amine
CID 105018423
cyclooctyl-(2-propan-2-yloxyphenyl)methanol
CID 80603247
(2-propan-2-yloxyphenyl)-(2,4,5-trimethyloxolan-3-yl)methanol
CID 115823700
(2-propan-2-yloxyphenyl)-(2,2,3,3-tetramethylcyclopropyl)methanol
CID 115823724
piperidin-3-yl-(2-propan-2-yloxyphenyl)methanol
CID 80559408
(2-chlorothiophen-3-yl)-(5-methyloxolan-3-yl)methanol
CID 130655294
(5-bromo-2-fluorophenyl)-(5-methyloxolan-3-yl)methanol
CID 115820673
(4-chlorophenyl)-(5-methyloxolan-3-yl)methanol
CID 114826660
1-(2-propan-2-yloxyphenyl)propane-1,2-diol
CID 103452569
(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-(5-methyloxolan-3-yl)methanol
CID 114826706
(2-fluoro-3-methoxyphenyl)-(5-methyloxolan-3-yl)methanamine
CID 105025195
(3,4-difluorophenyl)-(5-methyloxolan-3-yl)methanol
CID 114826691

Frequently Asked Questions

What is the IUPAC name of (5-methyloxolan-3-yl)-(2-propan-2-yloxyphenyl)methanol?
The IUPAC name of (5-methyloxolan-3-yl)-(2-propan-2-yloxyphenyl)methanol (CID 115823707) is (5-methyloxolan-3-yl)-(2-propan-2-yloxyphenyl)methanol.
What is the SMILES notation for (5-methyloxolan-3-yl)-(2-propan-2-yloxyphenyl)methanol?
The canonical SMILES for (5-methyloxolan-3-yl)-(2-propan-2-yloxyphenyl)methanol is CC(C)Oc1ccccc1C(O)C1COC(C)C1.
What is the InChIKey of (5-methyloxolan-3-yl)-(2-propan-2-yloxyphenyl)methanol?
The InChIKey is HPWUBNAIAWKBDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22O3/c1-10(2)18-14-7-5-4-6-13(14)15(16)12-8-11(3)17-9-12/h4-7,10-12,15-16H,8-9H2,1-3H3.
What are the key properties of (5-methyloxolan-3-yl)-(2-propan-2-yloxyphenyl)methanol?
(5-methyloxolan-3-yl)-(2-propan-2-yloxyphenyl)methanol has a molecular weight of 250.34 g/mol, XLogP of 2.93, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5-methyloxolan-3-yl)-(2-propan-2-yloxyphenyl)methanol is sourced from PubChem (CID 115823707), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).