(1R)-2-[(2-methoxy-3-methylphenyl)methyl]cyclohexan-1-ol

C15H22O2 — CID 164674726

IUPAC(1R)-2-[(2-methoxy-3-methylphenyl)methyl]cyclohexan-1-ol
SMILESCOc1c(C)cccc1CC1CCCC[C@H]1O
InChIInChI=1S/C15H22O2/c1-11-6-5-8-13(15(11)17-2)10-12-7-3-4-9-14(12)16/h5-6,8,12,14,16H,3-4,7,9-10H2,1-2H3/t12?,14-/m1/s1
InChIKeyAXRNCOKMYAIAJV-TYZXPVIJSA-N
MW234.34 g/mol
LogP3.10
Rot. Bonds3

About (1R)-2-[(2-methoxy-3-methylphenyl)methyl]cyclohexan-1-ol

(1R)-2-[(2-methoxy-3-methylphenyl)methyl]cyclohexan-1-ol (PubChem CID 164674726) has the molecular formula C15H22O2 and a molecular weight of 234.34 g/mol. Its IUPAC name is (1R)-2-[(2-methoxy-3-methylphenyl)methyl]cyclohexan-1-ol.

Molecular Properties

Compound Name(1R)-2-[(2-methoxy-3-methylphenyl)methyl]cyclohexan-1-ol
PubChem CID164674726
Molecular FormulaC15H22O2
Molecular Weight234.34 g/mol
Exact Mass234.16
IUPAC Name(1R)-2-[(2-methoxy-3-methylphenyl)methyl]cyclohexan-1-ol
SMILESCOc1c(C)cccc1CC1CCCC[C@H]1O
InChIInChI=1S/C15H22O2/c1-11-6-5-8-13(15(11)17-2)10-12-7-3-4-9-14(12)16/h5-6,8,12,14,16H,3-4,7,9-10H2,1-2H3/t12?,14-/m1/s1
InChIKeyAXRNCOKMYAIAJV-TYZXPVIJSA-N
XLogP3.10
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.34
LogP ≤ 53.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (1R)-2-[(2-methoxy-3-methylphenyl)methyl]cyclohexan-1-ol?
The IUPAC name of (1R)-2-[(2-methoxy-3-methylphenyl)methyl]cyclohexan-1-ol (CID 164674726) is (1R)-2-[(2-methoxy-3-methylphenyl)methyl]cyclohexan-1-ol.
What is the SMILES notation for (1R)-2-[(2-methoxy-3-methylphenyl)methyl]cyclohexan-1-ol?
The canonical SMILES for (1R)-2-[(2-methoxy-3-methylphenyl)methyl]cyclohexan-1-ol is COc1c(C)cccc1CC1CCCC[C@H]1O.
What is the InChIKey of (1R)-2-[(2-methoxy-3-methylphenyl)methyl]cyclohexan-1-ol?
The InChIKey is AXRNCOKMYAIAJV-TYZXPVIJSA-N. The full InChI is InChI=1S/C15H22O2/c1-11-6-5-8-13(15(11)17-2)10-12-7-3-4-9-14(12)16/h5-6,8,12,14,16H,3-4,7,9-10H2,1-2H3/t12?,14-/m1/s1.
What are the key properties of (1R)-2-[(2-methoxy-3-methylphenyl)methyl]cyclohexan-1-ol?
(1R)-2-[(2-methoxy-3-methylphenyl)methyl]cyclohexan-1-ol has a molecular weight of 234.34 g/mol, XLogP of 3.10, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-2-[(2-methoxy-3-methylphenyl)methyl]cyclohexan-1-ol is sourced from PubChem (CID 164674726), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).