3-methyl-4-[[2-methyl-6-(methylamino)phenyl]methoxy]phenol

C16H19NO2 — CID 129110182

IUPAC3-methyl-4-[[2-methyl-6-(methylamino)phenyl]methoxy]phenol
SMILESCNc1cccc(C)c1COc1ccc(O)cc1C
InChIInChI=1S/C16H19NO2/c1-11-5-4-6-15(17-3)14(11)10-19-16-8-7-13(18)9-12(16)2/h4-9,17-18H,10H2,1-3H3
InChIKeyAEIORHLYPGSIDB-UHFFFAOYSA-N
MW257.33 g/mol
LogP3.63
Rot. Bonds4

About 3-methyl-4-[[2-methyl-6-(methylamino)phenyl]methoxy]phenol

3-methyl-4-[[2-methyl-6-(methylamino)phenyl]methoxy]phenol (PubChem CID 129110182) has the molecular formula C16H19NO2 and a molecular weight of 257.33 g/mol. Its IUPAC name is 3-methyl-4-[[2-methyl-6-(methylamino)phenyl]methoxy]phenol.

Molecular Properties

Compound Name3-methyl-4-[[2-methyl-6-(methylamino)phenyl]methoxy]phenol
PubChem CID129110182
Molecular FormulaC16H19NO2
Molecular Weight257.33 g/mol
Exact Mass257.14
IUPAC Name3-methyl-4-[[2-methyl-6-(methylamino)phenyl]methoxy]phenol
SMILESCNc1cccc(C)c1COc1ccc(O)cc1C
InChIInChI=1S/C16H19NO2/c1-11-5-4-6-15(17-3)14(11)10-19-16-8-7-13(18)9-12(16)2/h4-9,17-18H,10H2,1-3H3
InChIKeyAEIORHLYPGSIDB-UHFFFAOYSA-N
XLogP3.63
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.33
LogP ≤ 53.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-methyl-4-[[2-methyl-6-(methylamino)phenyl]methoxy]phenol?
The IUPAC name of 3-methyl-4-[[2-methyl-6-(methylamino)phenyl]methoxy]phenol (CID 129110182) is 3-methyl-4-[[2-methyl-6-(methylamino)phenyl]methoxy]phenol.
What is the SMILES notation for 3-methyl-4-[[2-methyl-6-(methylamino)phenyl]methoxy]phenol?
The canonical SMILES for 3-methyl-4-[[2-methyl-6-(methylamino)phenyl]methoxy]phenol is CNc1cccc(C)c1COc1ccc(O)cc1C.
What is the InChIKey of 3-methyl-4-[[2-methyl-6-(methylamino)phenyl]methoxy]phenol?
The InChIKey is AEIORHLYPGSIDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19NO2/c1-11-5-4-6-15(17-3)14(11)10-19-16-8-7-13(18)9-12(16)2/h4-9,17-18H,10H2,1-3H3.
What are the key properties of 3-methyl-4-[[2-methyl-6-(methylamino)phenyl]methoxy]phenol?
3-methyl-4-[[2-methyl-6-(methylamino)phenyl]methoxy]phenol has a molecular weight of 257.33 g/mol, XLogP of 3.63, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-4-[[2-methyl-6-(methylamino)phenyl]methoxy]phenol is sourced from PubChem (CID 129110182), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).