5-[(2R)-2-(3,5-dimethoxy-4-methylphenyl)-2-hydroxyethyl]-2-methoxyphenol

C18H22O5 — CID 130324218

IUPAC5-[(2R)-2-(3,5-dimethoxy-4-methylphenyl)-2-hydroxyethyl]-2-methoxyphenol
SMILESCOc1ccc(C[C@@H](O)c2cc(OC)c(C)c(OC)c2)cc1O
InChIInChI=1S/C18H22O5/c1-11-17(22-3)9-13(10-18(11)23-4)14(19)7-12-5-6-16(21-2)15(20)8-12/h5-6,8-10,14,19-20H,7H2,1-4H3/t14-/m1/s1
InChIKeyCCXFVVZHQWZGOK-CQSZACIVSA-N
MW318.37 g/mol
LogP3.00
Rot. Bonds6

About 5-[(2R)-2-(3,5-dimethoxy-4-methylphenyl)-2-hydroxyethyl]-2-methoxyphenol

5-[(2R)-2-(3,5-dimethoxy-4-methylphenyl)-2-hydroxyethyl]-2-methoxyphenol (PubChem CID 130324218) has the molecular formula C18H22O5 and a molecular weight of 318.37 g/mol. Its IUPAC name is 5-[(2R)-2-(3,5-dimethoxy-4-methylphenyl)-2-hydroxyethyl]-2-methoxyphenol.

Molecular Properties

Compound Name5-[(2R)-2-(3,5-dimethoxy-4-methylphenyl)-2-hydroxyethyl]-2-methoxyphenol
PubChem CID130324218
Molecular FormulaC18H22O5
Molecular Weight318.37 g/mol
Exact Mass318.15
IUPAC Name5-[(2R)-2-(3,5-dimethoxy-4-methylphenyl)-2-hydroxyethyl]-2-methoxyphenol
SMILESCOc1ccc(C[C@@H](O)c2cc(OC)c(C)c(OC)c2)cc1O
InChIInChI=1S/C18H22O5/c1-11-17(22-3)9-13(10-18(11)23-4)14(19)7-12-5-6-16(21-2)15(20)8-12/h5-6,8-10,14,19-20H,7H2,1-4H3/t14-/m1/s1
InChIKeyCCXFVVZHQWZGOK-CQSZACIVSA-N
XLogP3.00
TPSA68.15 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.37
LogP ≤ 53.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

5-[2-[1-(3-hydroxy-4-methoxyphenyl)propan-2-yloxy]propyl]-2-methoxyphenol
CID 139528672
3-(3-hydroxy-4-methoxyphenyl)-2-methylpropanal
CID 83830640
5-[(2R)-2-hydroxy-2-(3,4,5-trimethoxyphenyl)ethyl]-2-methoxyphenol;quinoline
CID 135346888
diethyl 2-[(3-hydroxy-4-methoxyphenyl)methyl]propanedioate
CID 59114437
2-methoxy-5-(2-methylpentyl)phenol
CID 154974152
2-(3,4-dimethylphenyl)-3-(3-hydroxy-4-methoxyphenyl)propanoic acid
CID 82160556
5-(aminomethyl)-2-methoxyphenol
CID 1132998
5-[4-(3-hydroxy-4-methoxyphenyl)butyl]-2-methoxyphenol
CID 57066187
[(1R)-2-(3-hydroxy-4-methoxyphenyl)-1-(3,4,5-trimethoxyphenyl)ethyl] carbonochloridate
CID 87446204
3-(3-hydroxy-4-methoxyphenyl)-2-(2-methoxyphenyl)propanoic acid
CID 83950546
5-[(2S,3R)-4-(3-hydroxy-4-methoxyphenyl)-2,3-dimethylbutyl]-2,3-dimethoxyphenol
CID 146075484
(3-hydroxy-4-methoxyphenyl)methyl-methylazanium
CID 7298318

Frequently Asked Questions

What is the IUPAC name of 5-[(2R)-2-(3,5-dimethoxy-4-methylphenyl)-2-hydroxyethyl]-2-methoxyphenol?
The IUPAC name of 5-[(2R)-2-(3,5-dimethoxy-4-methylphenyl)-2-hydroxyethyl]-2-methoxyphenol (CID 130324218) is 5-[(2R)-2-(3,5-dimethoxy-4-methylphenyl)-2-hydroxyethyl]-2-methoxyphenol.
What is the SMILES notation for 5-[(2R)-2-(3,5-dimethoxy-4-methylphenyl)-2-hydroxyethyl]-2-methoxyphenol?
The canonical SMILES for 5-[(2R)-2-(3,5-dimethoxy-4-methylphenyl)-2-hydroxyethyl]-2-methoxyphenol is COc1ccc(C[C@@H](O)c2cc(OC)c(C)c(OC)c2)cc1O.
What is the InChIKey of 5-[(2R)-2-(3,5-dimethoxy-4-methylphenyl)-2-hydroxyethyl]-2-methoxyphenol?
The InChIKey is CCXFVVZHQWZGOK-CQSZACIVSA-N. The full InChI is InChI=1S/C18H22O5/c1-11-17(22-3)9-13(10-18(11)23-4)14(19)7-12-5-6-16(21-2)15(20)8-12/h5-6,8-10,14,19-20H,7H2,1-4H3/t14-/m1/s1.
What are the key properties of 5-[(2R)-2-(3,5-dimethoxy-4-methylphenyl)-2-hydroxyethyl]-2-methoxyphenol?
5-[(2R)-2-(3,5-dimethoxy-4-methylphenyl)-2-hydroxyethyl]-2-methoxyphenol has a molecular weight of 318.37 g/mol, XLogP of 3.00, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(2R)-2-(3,5-dimethoxy-4-methylphenyl)-2-hydroxyethyl]-2-methoxyphenol is sourced from PubChem (CID 130324218), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).