(2-ethoxy-5-methylphenyl)-(2-methyloxolan-3-yl)methanol

C15H22O3 — CID 79762889

IUPAC(2-ethoxy-5-methylphenyl)-(2-methyloxolan-3-yl)methanol
SMILESCCOc1ccc(C)cc1C(O)C1CCOC1C
InChIInChI=1S/C15H22O3/c1-4-17-14-6-5-10(2)9-13(14)15(16)12-7-8-18-11(12)3/h5-6,9,11-12,15-16H,4,7-8H2,1-3H3
InChIKeyIEESAHBUKXCWKE-UHFFFAOYSA-N
MW250.34 g/mol
LogP2.85
Rot. Bonds4

About (2-ethoxy-5-methylphenyl)-(2-methyloxolan-3-yl)methanol

(2-ethoxy-5-methylphenyl)-(2-methyloxolan-3-yl)methanol (PubChem CID 79762889) has the molecular formula C15H22O3 and a molecular weight of 250.34 g/mol. Its IUPAC name is (2-ethoxy-5-methylphenyl)-(2-methyloxolan-3-yl)methanol.

Molecular Properties

Compound Name(2-ethoxy-5-methylphenyl)-(2-methyloxolan-3-yl)methanol
PubChem CID79762889
Molecular FormulaC15H22O3
Molecular Weight250.34 g/mol
Exact Mass250.16
IUPAC Name(2-ethoxy-5-methylphenyl)-(2-methyloxolan-3-yl)methanol
SMILESCCOc1ccc(C)cc1C(O)C1CCOC1C
InChIInChI=1S/C15H22O3/c1-4-17-14-6-5-10(2)9-13(14)15(16)12-7-8-18-11(12)3/h5-6,9,11-12,15-16H,4,7-8H2,1-3H3
InChIKeyIEESAHBUKXCWKE-UHFFFAOYSA-N
XLogP2.85
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 ≤ 52.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2,4-dimethylphenyl)-(2-methyloxolan-3-yl)methanol
CID 79762886
(1R)-1-(2-ethoxy-5-methylphenyl)ethanol
CID 63364902
1-(2-ethoxy-5-methylphenyl)-3-(oxolan-2-yl)propan-1-ol
CID 65158041
1-(2-ethoxy-5-methylphenyl)-3-(oxan-2-yl)propan-1-ol
CID 63953787
(2-bromo-4,5-dimethoxyphenyl)-(2-methyloxolan-3-yl)methanol
CID 79762979
2-[bromo-(2-ethoxy-5-methylphenyl)methyl]oxane
CID 55057373
3-cyclohexyl-1-(2-ethoxy-5-methylphenyl)propan-1-ol
CID 63427299
(2-fluorophenyl)-(2-methyloxolan-3-yl)methanol
CID 115781704
N-[(2-fluoro-5-methylphenyl)-(2-methyloxolan-3-yl)methyl]propan-1-amine
CID 115852879
2-[chloro(cyclopentyl)methyl]-1-ethoxy-4-methylbenzene
CID 63447510
2-(cyclopropylamino)-1-(2-ethoxy-5-methylphenyl)-3-methylbutan-1-ol
CID 82315219
3-(3,5-dimethylpiperidin-1-yl)-1-(2-ethoxy-5-methylphenyl)propan-1-ol
CID 82073989

Frequently Asked Questions

What is the IUPAC name of (2-ethoxy-5-methylphenyl)-(2-methyloxolan-3-yl)methanol?
The IUPAC name of (2-ethoxy-5-methylphenyl)-(2-methyloxolan-3-yl)methanol (CID 79762889) is (2-ethoxy-5-methylphenyl)-(2-methyloxolan-3-yl)methanol.
What is the SMILES notation for (2-ethoxy-5-methylphenyl)-(2-methyloxolan-3-yl)methanol?
The canonical SMILES for (2-ethoxy-5-methylphenyl)-(2-methyloxolan-3-yl)methanol is CCOc1ccc(C)cc1C(O)C1CCOC1C.
What is the InChIKey of (2-ethoxy-5-methylphenyl)-(2-methyloxolan-3-yl)methanol?
The InChIKey is IEESAHBUKXCWKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22O3/c1-4-17-14-6-5-10(2)9-13(14)15(16)12-7-8-18-11(12)3/h5-6,9,11-12,15-16H,4,7-8H2,1-3H3.
What are the key properties of (2-ethoxy-5-methylphenyl)-(2-methyloxolan-3-yl)methanol?
(2-ethoxy-5-methylphenyl)-(2-methyloxolan-3-yl)methanol has a molecular weight of 250.34 g/mol, XLogP of 2.85, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2-ethoxy-5-methylphenyl)-(2-methyloxolan-3-yl)methanol is sourced from PubChem (CID 79762889), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).