1-methoxy-5-(oxolan-2-yl)-1-phenylpentan-2-ol

C16H24O3 — CID 116756915

IUPAC1-methoxy-5-(oxolan-2-yl)-1-phenylpentan-2-ol
SMILESCOC(c1ccccc1)C(O)CCCC1CCCO1
InChIInChI=1S/C16H24O3/c1-18-16(13-7-3-2-4-8-13)15(17)11-5-9-14-10-6-12-19-14/h2-4,7-8,14-17H,5-6,9-12H2,1H3
InChIKeyPEBJQMDKKJDSND-UHFFFAOYSA-N
MW264.37 g/mol
LogP3.08
Rot. Bonds7

About 1-methoxy-5-(oxolan-2-yl)-1-phenylpentan-2-ol

1-methoxy-5-(oxolan-2-yl)-1-phenylpentan-2-ol (PubChem CID 116756915) has the molecular formula C16H24O3 and a molecular weight of 264.37 g/mol. Its IUPAC name is 1-methoxy-5-(oxolan-2-yl)-1-phenylpentan-2-ol.

Molecular Properties

Compound Name1-methoxy-5-(oxolan-2-yl)-1-phenylpentan-2-ol
PubChem CID116756915
Molecular FormulaC16H24O3
Molecular Weight264.37 g/mol
Exact Mass264.17
IUPAC Name1-methoxy-5-(oxolan-2-yl)-1-phenylpentan-2-ol
SMILESCOC(c1ccccc1)C(O)CCCC1CCCO1
InChIInChI=1S/C16H24O3/c1-18-16(13-7-3-2-4-8-13)15(17)11-5-9-14-10-6-12-19-14/h2-4,7-8,14-17H,5-6,9-12H2,1H3
InChIKeyPEBJQMDKKJDSND-UHFFFAOYSA-N
XLogP3.08
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 53.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

6-(oxolan-2-yl)-2-phenylhexan-3-ol
CID 65162298
1-ethoxy-5-(oxolan-2-yl)-1-phenylpentan-2-amine
CID 116773427
N-methyl-5-(oxolan-2-yl)-2-phenylpentan-1-amine
CID 65431144
4-(oxolan-2-yl)-1-(1-phenylcyclopropyl)butan-1-ol
CID 65167277
1-(oxolan-2-yl)octane-4,5-diol
CID 103454832
1-methoxy-6-methyl-1-phenylheptan-2-ol
CID 116756994
2-[3-(oxolan-2-yl)propylamino]-1-phenylethanol
CID 65164044
N-ethyl-1-(oxolan-2-yl)-5-phenylheptan-4-amine
CID 104992984
2-(2-methylphenyl)-5-(oxolan-2-yl)pentanoic acid
CID 79421580
1-amino-7-(oxolan-2-yl)-1-phenylheptan-4-one
CID 116570924
2-(7-phenyloctyl)oxetane
CID 173415617
1-(2,6-dichlorophenyl)-4-(oxolan-2-yl)butan-1-ol
CID 65162393

Frequently Asked Questions

What is the IUPAC name of 1-methoxy-5-(oxolan-2-yl)-1-phenylpentan-2-ol?
The IUPAC name of 1-methoxy-5-(oxolan-2-yl)-1-phenylpentan-2-ol (CID 116756915) is 1-methoxy-5-(oxolan-2-yl)-1-phenylpentan-2-ol.
What is the SMILES notation for 1-methoxy-5-(oxolan-2-yl)-1-phenylpentan-2-ol?
The canonical SMILES for 1-methoxy-5-(oxolan-2-yl)-1-phenylpentan-2-ol is COC(c1ccccc1)C(O)CCCC1CCCO1.
What is the InChIKey of 1-methoxy-5-(oxolan-2-yl)-1-phenylpentan-2-ol?
The InChIKey is PEBJQMDKKJDSND-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24O3/c1-18-16(13-7-3-2-4-8-13)15(17)11-5-9-14-10-6-12-19-14/h2-4,7-8,14-17H,5-6,9-12H2,1H3.
What are the key properties of 1-methoxy-5-(oxolan-2-yl)-1-phenylpentan-2-ol?
1-methoxy-5-(oxolan-2-yl)-1-phenylpentan-2-ol has a molecular weight of 264.37 g/mol, XLogP of 3.08, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methoxy-5-(oxolan-2-yl)-1-phenylpentan-2-ol is sourced from PubChem (CID 116756915), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).