5-methoxy-2-[(2,2,6-trimethylmorpholin-4-yl)methyl]phenol

C15H23NO3 — CID 82978872

IUPAC5-methoxy-2-[(2,2,6-trimethylmorpholin-4-yl)methyl]phenol
SMILESCOc1ccc(CN2CC(C)OC(C)(C)C2)c(O)c1
InChIInChI=1S/C15H23NO3/c1-11-8-16(10-15(2,3)19-11)9-12-5-6-13(18-4)7-14(12)17/h5-7,11,17H,8-10H2,1-4H3
InChIKeyOXKJBAFWTJUVAM-UHFFFAOYSA-N
MW265.35 g/mol
LogP2.40
Rot. Bonds3

About 5-methoxy-2-[(2,2,6-trimethylmorpholin-4-yl)methyl]phenol

5-methoxy-2-[(2,2,6-trimethylmorpholin-4-yl)methyl]phenol (PubChem CID 82978872) has the molecular formula C15H23NO3 and a molecular weight of 265.35 g/mol. Its IUPAC name is 5-methoxy-2-[(2,2,6-trimethylmorpholin-4-yl)methyl]phenol.

Molecular Properties

Compound Name5-methoxy-2-[(2,2,6-trimethylmorpholin-4-yl)methyl]phenol
PubChem CID82978872
Molecular FormulaC15H23NO3
Molecular Weight265.35 g/mol
Exact Mass265.17
IUPAC Name5-methoxy-2-[(2,2,6-trimethylmorpholin-4-yl)methyl]phenol
SMILESCOc1ccc(CN2CC(C)OC(C)(C)C2)c(O)c1
InChIInChI=1S/C15H23NO3/c1-11-8-16(10-15(2,3)19-11)9-12-5-6-13(18-4)7-14(12)17/h5-7,11,17H,8-10H2,1-4H3
InChIKeyOXKJBAFWTJUVAM-UHFFFAOYSA-N
XLogP2.40
TPSA41.93 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.35
LogP ≤ 52.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'mannich_A(296)', 'substructure': 'N/A'}

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Related Compounds

2,6-dimethoxy-4-[(2,2,6-trimethylmorpholin-4-yl)methyl]phenol
CID 78976743
methyl 2-[(2,2,6-trimethylmorpholin-4-yl)methyl]benzoate
CID 82969504
5-methoxy-2-[1-(2,2,6-trimethylmorpholin-4-yl)ethyl]phenol
CID 82978518
[4-[(2,5-dimethoxyphenyl)methyl]-6,6-dimethylmorpholin-2-yl]methanol
CID 114779927
1-[(2-hydroxy-4-methoxyphenyl)methyl]-4-methylpyrrolidine-3-carboxylic acid
CID 65065652
2-(2,4-dimethoxyphenyl)-1-[(6R)-2,2,6-trimethylmorpholin-4-yl]ethanone
CID 95586217
(3R)-1-[(2-hydroxy-4-methoxyphenyl)methyl]pyrrolidin-3-ol
CID 103882000
1-[(2-hydroxy-4-methoxyphenyl)methyl]piperidin-4-ol
CID 2845869
2-[(3-aminopyrrolidin-1-yl)methyl]-5-methoxyphenol
CID 62067190
4-bromo-2-methyl-6-[(2,2,6-trimethylmorpholin-4-yl)methyl]phenol
CID 112553577
3-[(2,2,6-trimethylmorpholin-4-yl)methyl]thiophene-2-carboxylic acid
CID 55246853
2-[(4-cyclopentylpiperazin-1-yl)methyl]-5-methoxyphenol
CID 82959226

Frequently Asked Questions

What is the IUPAC name of 5-methoxy-2-[(2,2,6-trimethylmorpholin-4-yl)methyl]phenol?
The IUPAC name of 5-methoxy-2-[(2,2,6-trimethylmorpholin-4-yl)methyl]phenol (CID 82978872) is 5-methoxy-2-[(2,2,6-trimethylmorpholin-4-yl)methyl]phenol.
What is the SMILES notation for 5-methoxy-2-[(2,2,6-trimethylmorpholin-4-yl)methyl]phenol?
The canonical SMILES for 5-methoxy-2-[(2,2,6-trimethylmorpholin-4-yl)methyl]phenol is COc1ccc(CN2CC(C)OC(C)(C)C2)c(O)c1.
What is the InChIKey of 5-methoxy-2-[(2,2,6-trimethylmorpholin-4-yl)methyl]phenol?
The InChIKey is OXKJBAFWTJUVAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO3/c1-11-8-16(10-15(2,3)19-11)9-12-5-6-13(18-4)7-14(12)17/h5-7,11,17H,8-10H2,1-4H3.
What are the key properties of 5-methoxy-2-[(2,2,6-trimethylmorpholin-4-yl)methyl]phenol?
5-methoxy-2-[(2,2,6-trimethylmorpholin-4-yl)methyl]phenol has a molecular weight of 265.35 g/mol, XLogP of 2.40, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methoxy-2-[(2,2,6-trimethylmorpholin-4-yl)methyl]phenol is sourced from PubChem (CID 82978872), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).