(2R)-2-(4-methoxy-3-methylphenyl)pentan-2-ol

C13H20O2 — CID 97294322

IUPAC(2R)-2-(4-methoxy-3-methylphenyl)pentan-2-ol
SMILESCCC[C@@](C)(O)c1ccc(OC)c(C)c1
InChIInChI=1S/C13H20O2/c1-5-8-13(3,14)11-6-7-12(15-4)10(2)9-11/h6-7,9,14H,5,8H2,1-4H3/t13-/m1/s1
InChIKeyIWZLJYKSIWGTNM-CYBMUJFWSA-N
MW208.30 g/mol
LogP3.01
Rot. Bonds4

About (2R)-2-(4-methoxy-3-methylphenyl)pentan-2-ol

(2R)-2-(4-methoxy-3-methylphenyl)pentan-2-ol (PubChem CID 97294322) has the molecular formula C13H20O2 and a molecular weight of 208.30 g/mol. Its IUPAC name is (2R)-2-(4-methoxy-3-methylphenyl)pentan-2-ol.

Molecular Properties

Compound Name(2R)-2-(4-methoxy-3-methylphenyl)pentan-2-ol
PubChem CID97294322
Molecular FormulaC13H20O2
Molecular Weight208.30 g/mol
Exact Mass208.15
IUPAC Name(2R)-2-(4-methoxy-3-methylphenyl)pentan-2-ol
SMILESCCC[C@@](C)(O)c1ccc(OC)c(C)c1
InChIInChI=1S/C13H20O2/c1-5-8-13(3,14)11-6-7-12(15-4)10(2)9-11/h6-7,9,14H,5,8H2,1-4H3/t13-/m1/s1
InChIKeyIWZLJYKSIWGTNM-CYBMUJFWSA-N
XLogP3.01
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.30
LogP ≤ 53.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2R)-2-(4-methoxy-3-methylphenyl)butan-2-ol
CID 97294196
2-(4-methoxy-3-methylphenyl)-2-methylpropan-1-ol
CID 82125771
1-methoxy-4-[2-(4-methoxy-3-methylphenyl)decan-2-yl]-2-methylbenzene
CID 171057442
2-(4-methoxy-3-methylphenyl)butan-2-amine
CID 82469033
4-(4-ethoxy-3-methylphenyl)pentane-1,4-diol
CID 116861567
2-(3,4-dimethylphenyl)decan-2-ol
CID 65147034
1,1-bis(4-methoxy-3-methylphenyl)-2-phenylethanol
CID 57233562
1-methoxy-4-(2-methoxypropan-2-yl)-2-methylbenzene
CID 20723728
2-methoxy-5-(2-methylpentan-2-yl)phenol
CID 23093288
2-(3,4-dimethylphenyl)-1-(3-fluoro-4-methoxyphenyl)propan-2-ol
CID 65146874
2-(3,4-dimethoxyphenyl)-6,6,6-trifluorohexan-2-ol
CID 116535938
4-amino-4-(4-methoxy-3-methylphenyl)pentan-1-ol
CID 116861674

Frequently Asked Questions

What is the IUPAC name of (2R)-2-(4-methoxy-3-methylphenyl)pentan-2-ol?
The IUPAC name of (2R)-2-(4-methoxy-3-methylphenyl)pentan-2-ol (CID 97294322) is (2R)-2-(4-methoxy-3-methylphenyl)pentan-2-ol.
What is the SMILES notation for (2R)-2-(4-methoxy-3-methylphenyl)pentan-2-ol?
The canonical SMILES for (2R)-2-(4-methoxy-3-methylphenyl)pentan-2-ol is CCC[C@@](C)(O)c1ccc(OC)c(C)c1.
What is the InChIKey of (2R)-2-(4-methoxy-3-methylphenyl)pentan-2-ol?
The InChIKey is IWZLJYKSIWGTNM-CYBMUJFWSA-N. The full InChI is InChI=1S/C13H20O2/c1-5-8-13(3,14)11-6-7-12(15-4)10(2)9-11/h6-7,9,14H,5,8H2,1-4H3/t13-/m1/s1.
What are the key properties of (2R)-2-(4-methoxy-3-methylphenyl)pentan-2-ol?
(2R)-2-(4-methoxy-3-methylphenyl)pentan-2-ol has a molecular weight of 208.30 g/mol, XLogP of 3.01, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(4-methoxy-3-methylphenyl)pentan-2-ol is sourced from PubChem (CID 97294322), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).