5-methoxy-3-phenylpentan-1-ol

C12H18O2 — CID 542519

IUPAC5-methoxy-3-phenylpentan-1-ol
SMILESCOCCC(CCO)c1ccccc1
InChIInChI=1S/C12H18O2/c1-14-10-8-12(7-9-13)11-5-3-2-4-6-11/h2-6,12-13H,7-10H2,1H3
InChIKeyOYJFQZSMBJHKAC-UHFFFAOYSA-N
MW194.27 g/mol
LogP2.19
Rot. Bonds6

About 5-methoxy-3-phenylpentan-1-ol

5-methoxy-3-phenylpentan-1-ol (PubChem CID 542519) has the molecular formula C12H18O2 and a molecular weight of 194.27 g/mol. Its IUPAC name is 5-methoxy-3-phenylpentan-1-ol.

Molecular Properties

Compound Name5-methoxy-3-phenylpentan-1-ol
PubChem CID542519
Molecular FormulaC12H18O2
Molecular Weight194.27 g/mol
Exact Mass194.13
IUPAC Name5-methoxy-3-phenylpentan-1-ol
SMILESCOCCC(CCO)c1ccccc1
InChIInChI=1S/C12H18O2/c1-14-10-8-12(7-9-13)11-5-3-2-4-6-11/h2-6,12-13H,7-10H2,1H3
InChIKeyOYJFQZSMBJHKAC-UHFFFAOYSA-N
XLogP2.19
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.27
LogP ≤ 52.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-Phenylethanol
CID 6054
Benzenepropanol
CID 31234
1-Phenyl-3-methyl-3-pentanol
CID 61516
2-Methyl-4-phenyl-2-butanol
CID 7632
alpha-(2-Methylpropyl)benzeneethanol
CID 62661
2-Phenyl-1-propanol
CID 14295
4-Phenyl-2-butanol
CID 61302
5-Phenyl-1-pentanol
CID 61523
2-Pentylcinnamic alcohol
CID 5368491
1-Phenyl-2-pentanol
CID 61202
2-Pentyl-3-phenylprop-2-en-1-ol
CID 6076971
2-Phenylcyclohexanol
CID 15046

Frequently Asked Questions

What is the IUPAC name of 5-methoxy-3-phenylpentan-1-ol?
The IUPAC name of 5-methoxy-3-phenylpentan-1-ol (CID 542519) is 5-methoxy-3-phenylpentan-1-ol.
What is the SMILES notation for 5-methoxy-3-phenylpentan-1-ol?
The canonical SMILES for 5-methoxy-3-phenylpentan-1-ol is COCCC(CCO)c1ccccc1.
What is the InChIKey of 5-methoxy-3-phenylpentan-1-ol?
The InChIKey is OYJFQZSMBJHKAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18O2/c1-14-10-8-12(7-9-13)11-5-3-2-4-6-11/h2-6,12-13H,7-10H2,1H3.
What are the key properties of 5-methoxy-3-phenylpentan-1-ol?
5-methoxy-3-phenylpentan-1-ol has a molecular weight of 194.27 g/mol, XLogP of 2.19, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methoxy-3-phenylpentan-1-ol is sourced from PubChem (CID 542519), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).