4-[[ethyl(methyl)amino]-hydroxymethyl]phenol

C10H15NO2 — CID 67460714

IUPAC4-[[ethyl(methyl)amino]-hydroxymethyl]phenol
SMILESCCN(C)C(O)c1ccc(O)cc1
InChIInChI=1S/C10H15NO2/c1-3-11(2)10(13)8-4-6-9(12)7-5-8/h4-7,10,12-13H,3H2,1-2H3
InChIKeyWAXVNSMYJSNAOU-UHFFFAOYSA-N
MW181.23 g/mol
LogP1.33
Rot. Bonds3

About 4-[[ethyl(methyl)amino]-hydroxymethyl]phenol

4-[[ethyl(methyl)amino]-hydroxymethyl]phenol (PubChem CID 67460714) has the molecular formula C10H15NO2 and a molecular weight of 181.23 g/mol. Its IUPAC name is 4-[[ethyl(methyl)amino]-hydroxymethyl]phenol.

Molecular Properties

Compound Name4-[[ethyl(methyl)amino]-hydroxymethyl]phenol
PubChem CID67460714
Molecular FormulaC10H15NO2
Molecular Weight181.23 g/mol
Exact Mass181.11
IUPAC Name4-[[ethyl(methyl)amino]-hydroxymethyl]phenol
SMILESCCN(C)C(O)c1ccc(O)cc1
InChIInChI=1S/C10H15NO2/c1-3-11(2)10(13)8-4-6-9(12)7-5-8/h4-7,10,12-13H,3H2,1-2H3
InChIKeyWAXVNSMYJSNAOU-UHFFFAOYSA-N
XLogP1.33
TPSA43.70 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.23
LogP ≤ 51.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

4-[1-(diethylamino)propan-2-yl]phenol
CID 115025478
4-[1-(dimethylamino)ethyl]phenol
CID 3029886
4-[1-[butan-2-yl(methyl)amino]propyl]phenol
CID 82977219
3-[1-(4-hydroxyphenyl)ethyl-methylamino]-2-methylpropanoic acid
CID 65072257
dimethylamino-(4-fluorophenyl)methanol
CID 116909515
[(1R,2R)-1-hydroxy-1-(4-hydroxyphenyl)propan-2-yl]azanium
CID 6931144
4-[1-[2-(dimethylamino)propylamino]ethyl]phenol
CID 61043440
4-[1-(4-hydroxyphenyl)ethyl]phenol
CID 608116
4-[1-[2-[ethyl(methyl)amino]ethylamino]ethyl]phenol
CID 62636904
2-[ethyl(methyl)amino]-1-phenylpropan-1-ol
CID 10734
[1-hydroxy-1-(4-hydroxyphenyl)propan-2-yl]-propylazanium chloride
CID 110184055
4-[1-[1-methoxypropan-2-yl(methyl)amino]ethyl]phenol
CID 82982525

Frequently Asked Questions

What is the IUPAC name of 4-[[ethyl(methyl)amino]-hydroxymethyl]phenol?
The IUPAC name of 4-[[ethyl(methyl)amino]-hydroxymethyl]phenol (CID 67460714) is 4-[[ethyl(methyl)amino]-hydroxymethyl]phenol.
What is the SMILES notation for 4-[[ethyl(methyl)amino]-hydroxymethyl]phenol?
The canonical SMILES for 4-[[ethyl(methyl)amino]-hydroxymethyl]phenol is CCN(C)C(O)c1ccc(O)cc1.
What is the InChIKey of 4-[[ethyl(methyl)amino]-hydroxymethyl]phenol?
The InChIKey is WAXVNSMYJSNAOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15NO2/c1-3-11(2)10(13)8-4-6-9(12)7-5-8/h4-7,10,12-13H,3H2,1-2H3.
What are the key properties of 4-[[ethyl(methyl)amino]-hydroxymethyl]phenol?
4-[[ethyl(methyl)amino]-hydroxymethyl]phenol has a molecular weight of 181.23 g/mol, XLogP of 1.33, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[ethyl(methyl)amino]-hydroxymethyl]phenol is sourced from PubChem (CID 67460714), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).