3-(2-methoxyethoxy)-1-(3-propan-2-yloxyphenyl)propan-1-ol

C15H24O4 — CID 102927565

IUPAC3-(2-methoxyethoxy)-1-(3-propan-2-yloxyphenyl)propan-1-ol
SMILESCOCCOCCC(O)c1cccc(OC(C)C)c1
InChIInChI=1S/C15H24O4/c1-12(2)19-14-6-4-5-13(11-14)15(16)7-8-18-10-9-17-3/h4-6,11-12,15-16H,7-10H2,1-3H3
InChIKeyYCQRMOVZNSITBR-UHFFFAOYSA-N
MW268.35 g/mol
LogP2.56
Rot. Bonds9

About 3-(2-methoxyethoxy)-1-(3-propan-2-yloxyphenyl)propan-1-ol

3-(2-methoxyethoxy)-1-(3-propan-2-yloxyphenyl)propan-1-ol (PubChem CID 102927565) has the molecular formula C15H24O4 and a molecular weight of 268.35 g/mol. Its IUPAC name is 3-(2-methoxyethoxy)-1-(3-propan-2-yloxyphenyl)propan-1-ol.

Molecular Properties

Compound Name3-(2-methoxyethoxy)-1-(3-propan-2-yloxyphenyl)propan-1-ol
PubChem CID102927565
Molecular FormulaC15H24O4
Molecular Weight268.35 g/mol
Exact Mass268.17
IUPAC Name3-(2-methoxyethoxy)-1-(3-propan-2-yloxyphenyl)propan-1-ol
SMILESCOCCOCCC(O)c1cccc(OC(C)C)c1
InChIInChI=1S/C15H24O4/c1-12(2)19-14-6-4-5-13(11-14)15(16)7-8-18-10-9-17-3/h4-6,11-12,15-16H,7-10H2,1-3H3
InChIKeyYCQRMOVZNSITBR-UHFFFAOYSA-N
XLogP2.56
TPSA47.92 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.35
LogP ≤ 52.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-ethyl-3-(2-methoxyethoxy)-1-(3-propan-2-yloxyphenyl)propan-1-amine
CID 102928428
2-[2-(2-methoxyethoxy)ethoxy]-1-(4-propan-2-yloxyphenyl)ethanol
CID 104564711
(1S)-1-(3-propan-2-yloxyphenyl)ethanol
CID 75358098
1-ethyl-2-[2-hydroxy-2-(3-propan-2-yloxyphenyl)ethyl]-3-[3-(2-methoxyethoxy)propyl]guanidine;hydroiodide
CID 109491633
1-(3-propan-2-yloxyphenyl)-3-propoxypropan-1-amine
CID 105171328
1-[3-(2-methoxyethoxymethoxy)phenyl]ethane-1,2-diol
CID 76530110
3-(3-methylbutoxy)-1-(3-methylphenyl)propan-1-ol
CID 115001890
2-(2,6-dichlorophenyl)-1-(3-propan-2-yloxyphenyl)ethanol
CID 65145651
1-(3-methoxyphenyl)pentane-1,4-diol
CID 81134047
1-ethyl-2-[2-hydroxy-2-(3-propan-2-yloxyphenyl)ethyl]-3-(2-methoxyethyl)guanidine;hydroiodide
CID 109491751
1-(3-cyclopropyloxyphenyl)-3-propoxypropan-1-ol
CID 105131518
3-methyl-1-(3-propan-2-yloxyphenyl)butane-1,2-diol
CID 103456619

Frequently Asked Questions

What is the IUPAC name of 3-(2-methoxyethoxy)-1-(3-propan-2-yloxyphenyl)propan-1-ol?
The IUPAC name of 3-(2-methoxyethoxy)-1-(3-propan-2-yloxyphenyl)propan-1-ol (CID 102927565) is 3-(2-methoxyethoxy)-1-(3-propan-2-yloxyphenyl)propan-1-ol.
What is the SMILES notation for 3-(2-methoxyethoxy)-1-(3-propan-2-yloxyphenyl)propan-1-ol?
The canonical SMILES for 3-(2-methoxyethoxy)-1-(3-propan-2-yloxyphenyl)propan-1-ol is COCCOCCC(O)c1cccc(OC(C)C)c1.
What is the InChIKey of 3-(2-methoxyethoxy)-1-(3-propan-2-yloxyphenyl)propan-1-ol?
The InChIKey is YCQRMOVZNSITBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24O4/c1-12(2)19-14-6-4-5-13(11-14)15(16)7-8-18-10-9-17-3/h4-6,11-12,15-16H,7-10H2,1-3H3.
What are the key properties of 3-(2-methoxyethoxy)-1-(3-propan-2-yloxyphenyl)propan-1-ol?
3-(2-methoxyethoxy)-1-(3-propan-2-yloxyphenyl)propan-1-ol has a molecular weight of 268.35 g/mol, XLogP of 2.56, 9 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-methoxyethoxy)-1-(3-propan-2-yloxyphenyl)propan-1-ol is sourced from PubChem (CID 102927565), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).