2-(4-methoxy-3-methylphenyl)-2-(methylamino)ethanol

C11H17NO2 — CID 62132456

IUPAC2-(4-methoxy-3-methylphenyl)-2-(methylamino)ethanol
SMILESCNC(CO)c1ccc(OC)c(C)c1
InChIInChI=1S/C11H17NO2/c1-8-6-9(10(7-13)12-2)4-5-11(8)14-3/h4-6,10,12-13H,7H2,1-3H3
InChIKeyVABHLRYMEIMJLD-UHFFFAOYSA-N
MW195.26 g/mol
LogP1.26
Rot. Bonds4

About 2-(4-methoxy-3-methylphenyl)-2-(methylamino)ethanol

2-(4-methoxy-3-methylphenyl)-2-(methylamino)ethanol (PubChem CID 62132456) has the molecular formula C11H17NO2 and a molecular weight of 195.26 g/mol. Its IUPAC name is 2-(4-methoxy-3-methylphenyl)-2-(methylamino)ethanol.

Molecular Properties

Compound Name2-(4-methoxy-3-methylphenyl)-2-(methylamino)ethanol
PubChem CID62132456
Molecular FormulaC11H17NO2
Molecular Weight195.26 g/mol
Exact Mass195.13
IUPAC Name2-(4-methoxy-3-methylphenyl)-2-(methylamino)ethanol
SMILESCNC(CO)c1ccc(OC)c(C)c1
InChIInChI=1S/C11H17NO2/c1-8-6-9(10(7-13)12-2)4-5-11(8)14-3/h4-6,10,12-13H,7H2,1-3H3
InChIKeyVABHLRYMEIMJLD-UHFFFAOYSA-N
XLogP1.26
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.26
LogP ≤ 51.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(4-methoxy-3-methylphenyl)-2-(methylamino)ethanol?
The IUPAC name of 2-(4-methoxy-3-methylphenyl)-2-(methylamino)ethanol (CID 62132456) is 2-(4-methoxy-3-methylphenyl)-2-(methylamino)ethanol.
What is the SMILES notation for 2-(4-methoxy-3-methylphenyl)-2-(methylamino)ethanol?
The canonical SMILES for 2-(4-methoxy-3-methylphenyl)-2-(methylamino)ethanol is CNC(CO)c1ccc(OC)c(C)c1.
What is the InChIKey of 2-(4-methoxy-3-methylphenyl)-2-(methylamino)ethanol?
The InChIKey is VABHLRYMEIMJLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17NO2/c1-8-6-9(10(7-13)12-2)4-5-11(8)14-3/h4-6,10,12-13H,7H2,1-3H3.
What are the key properties of 2-(4-methoxy-3-methylphenyl)-2-(methylamino)ethanol?
2-(4-methoxy-3-methylphenyl)-2-(methylamino)ethanol has a molecular weight of 195.26 g/mol, XLogP of 1.26, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methoxy-3-methylphenyl)-2-(methylamino)ethanol is sourced from PubChem (CID 62132456), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).