2-[[2-hydroxyethyl(methyl)amino]methyl]-5-methoxyphenol

C11H17NO3 — CID 14295123

IUPAC2-[[2-hydroxyethyl(methyl)amino]methyl]-5-methoxyphenol
SMILESCOc1ccc(CN(C)CCO)c(O)c1
InChIInChI=1S/C11H17NO3/c1-12(5-6-13)8-9-3-4-10(15-2)7-11(9)14/h3-4,7,13-14H,5-6,8H2,1-2H3
InChIKeyZIZVVWBEADNQQX-UHFFFAOYSA-N
MW211.26 g/mol
LogP0.82
Rot. Bonds5

About 2-[[2-hydroxyethyl(methyl)amino]methyl]-5-methoxyphenol

2-[[2-hydroxyethyl(methyl)amino]methyl]-5-methoxyphenol (PubChem CID 14295123) has the molecular formula C11H17NO3 and a molecular weight of 211.26 g/mol. Its IUPAC name is 2-[[2-hydroxyethyl(methyl)amino]methyl]-5-methoxyphenol.

Molecular Properties

Compound Name2-[[2-hydroxyethyl(methyl)amino]methyl]-5-methoxyphenol
PubChem CID14295123
Molecular FormulaC11H17NO3
Molecular Weight211.26 g/mol
Exact Mass211.12
IUPAC Name2-[[2-hydroxyethyl(methyl)amino]methyl]-5-methoxyphenol
SMILESCOc1ccc(CN(C)CCO)c(O)c1
InChIInChI=1S/C11H17NO3/c1-12(5-6-13)8-9-3-4-10(15-2)7-11(9)14/h3-4,7,13-14H,5-6,8H2,1-2H3
InChIKeyZIZVVWBEADNQQX-UHFFFAOYSA-N
XLogP0.82
TPSA52.93 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.26
LogP ≤ 50.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 2-[[2-hydroxyethyl(methyl)amino]methyl]-5-methoxyphenol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-[(dimethylamino)methyl]-5-methoxyphenol
CID 18933640
2-[(2-hydroxy-4-methoxyphenyl)methyl-methylamino]-N-methylacetamide
CID 82977637
2-[(2-ethenyl-5-methoxyphenyl)methyl-methylamino]ethanol
CID 15154905
5-methoxy-2-[(4-methoxy-N-methylanilino)methyl]phenol
CID 82978581
4-methoxy-2-[[methyl(propyl)amino]methyl]phenol
CID 82977818
2-chloro-N-[(2-hydroxy-4-methoxyphenyl)methyl]-N-methylacetamide
CID 82110242
2-[3-(dimethylamino)propyl]-5-methoxyphenol
CID 170865157
5-methoxy-2-[(N,3,5-trimethylanilino)methyl]phenol
CID 82978542
2-[[2-ethoxyethyl(methyl)amino]methyl]-4-methoxyphenol
CID 82983680
5-methoxy-2-[[2-methoxyethyl(3-methoxypropyl)amino]methyl]phenol
CID 82978309
2-[methyl-[(2,4,5-trimethoxyphenyl)methyl]amino]ethanol
CID 112683473
2-[[2-bicyclo[2.2.1]heptanylmethyl(methyl)amino]methyl]-5-methoxyphenol
CID 82981204

Frequently Asked Questions

What is the IUPAC name of 2-[[2-hydroxyethyl(methyl)amino]methyl]-5-methoxyphenol?
The IUPAC name of 2-[[2-hydroxyethyl(methyl)amino]methyl]-5-methoxyphenol (CID 14295123) is 2-[[2-hydroxyethyl(methyl)amino]methyl]-5-methoxyphenol.
What is the SMILES notation for 2-[[2-hydroxyethyl(methyl)amino]methyl]-5-methoxyphenol?
The canonical SMILES for 2-[[2-hydroxyethyl(methyl)amino]methyl]-5-methoxyphenol is COc1ccc(CN(C)CCO)c(O)c1.
What is the InChIKey of 2-[[2-hydroxyethyl(methyl)amino]methyl]-5-methoxyphenol?
The InChIKey is ZIZVVWBEADNQQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17NO3/c1-12(5-6-13)8-9-3-4-10(15-2)7-11(9)14/h3-4,7,13-14H,5-6,8H2,1-2H3.
What are the key properties of 2-[[2-hydroxyethyl(methyl)amino]methyl]-5-methoxyphenol?
2-[[2-hydroxyethyl(methyl)amino]methyl]-5-methoxyphenol has a molecular weight of 211.26 g/mol, XLogP of 0.82, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2-hydroxyethyl(methyl)amino]methyl]-5-methoxyphenol is sourced from PubChem (CID 14295123), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).