(2R)-1-(4-methoxy-2-methylphenyl)propan-2-ol

C11H16O2 — CID 97009148

IUPAC(2R)-1-(4-methoxy-2-methylphenyl)propan-2-ol
SMILESCOc1ccc(C[C@@H](C)O)c(C)c1
InChIInChI=1S/C11H16O2/c1-8-6-11(13-3)5-4-10(8)7-9(2)12/h4-6,9,12H,7H2,1-3H3/t9-/m1/s1
InChIKeyMYIIBDMQFFNHQE-SECBINFHSA-N
MW180.25 g/mol
LogP1.93
Rot. Bonds3

About (2R)-1-(4-methoxy-2-methylphenyl)propan-2-ol

(2R)-1-(4-methoxy-2-methylphenyl)propan-2-ol (PubChem CID 97009148) has the molecular formula C11H16O2 and a molecular weight of 180.25 g/mol. Its IUPAC name is (2R)-1-(4-methoxy-2-methylphenyl)propan-2-ol.

Molecular Properties

Compound Name(2R)-1-(4-methoxy-2-methylphenyl)propan-2-ol
PubChem CID97009148
Molecular FormulaC11H16O2
Molecular Weight180.25 g/mol
Exact Mass180.12
IUPAC Name(2R)-1-(4-methoxy-2-methylphenyl)propan-2-ol
SMILESCOc1ccc(C[C@@H](C)O)c(C)c1
InChIInChI=1S/C11H16O2/c1-8-6-11(13-3)5-4-10(8)7-9(2)12/h4-6,9,12H,7H2,1-3H3/t9-/m1/s1
InChIKeyMYIIBDMQFFNHQE-SECBINFHSA-N
XLogP1.93
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.25
LogP ≤ 51.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2R)-1-(5-methoxy-2-methylphenyl)propan-2-ol
CID 68649923
(2R)-1-(2,4-dimethoxyphenyl)propan-2-ol
CID 75406786
1-[4-methoxy-2-(methoxymethyl)phenyl]propan-2-ol
CID 117300552
1-(3-bromo-2-methylpropyl)-4-methoxy-2-methylbenzene
CID 65316290
1-(4-fluoro-2-methylphenyl)propan-2-ol
CID 91636360
3-amino-4-(4-methoxy-2-methylphenyl)butanoic acid
CID 82351098
ethane;1-ethyl-4-methoxy-2-methylbenzene
CID 142129466
1-(4-methoxy-2-methylphenyl)-4,4-dimethylpentan-3-ol
CID 65316028
1-(4-methoxy-2-methylphenyl)hexane-3,4-diol
CID 83936503
carbanide;1-ethyl-4-methoxy-2-methylbenzene;yttrium
CID 161093717
4-methoxy-1-[(4-methoxyphenyl)methyl]-2-methylbenzene
CID 15654338
O-[(4-methoxy-2-methylphenyl)methyl]hydroxylamine
CID 117276532

Frequently Asked Questions

What is the IUPAC name of (2R)-1-(4-methoxy-2-methylphenyl)propan-2-ol?
The IUPAC name of (2R)-1-(4-methoxy-2-methylphenyl)propan-2-ol (CID 97009148) is (2R)-1-(4-methoxy-2-methylphenyl)propan-2-ol.
What is the SMILES notation for (2R)-1-(4-methoxy-2-methylphenyl)propan-2-ol?
The canonical SMILES for (2R)-1-(4-methoxy-2-methylphenyl)propan-2-ol is COc1ccc(C[C@@H](C)O)c(C)c1.
What is the InChIKey of (2R)-1-(4-methoxy-2-methylphenyl)propan-2-ol?
The InChIKey is MYIIBDMQFFNHQE-SECBINFHSA-N. The full InChI is InChI=1S/C11H16O2/c1-8-6-11(13-3)5-4-10(8)7-9(2)12/h4-6,9,12H,7H2,1-3H3/t9-/m1/s1.
What are the key properties of (2R)-1-(4-methoxy-2-methylphenyl)propan-2-ol?
(2R)-1-(4-methoxy-2-methylphenyl)propan-2-ol has a molecular weight of 180.25 g/mol, XLogP of 1.93, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-1-(4-methoxy-2-methylphenyl)propan-2-ol is sourced from PubChem (CID 97009148), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).