4-methyl-2-[1-(methylamino)ethyl]phenol

C10H15NO — CID 43504566

IUPAC4-methyl-2-[1-(methylamino)ethyl]phenol
SMILESCNC(C)c1cc(C)ccc1O
InChIInChI=1S/C10H15NO/c1-7-4-5-10(12)9(6-7)8(2)11-3/h4-6,8,11-12H,1-3H3
InChIKeyUUGWFKBHAKBDLO-UHFFFAOYSA-N
MW165.24 g/mol
LogP1.98
Rot. Bonds2

About 4-methyl-2-[1-(methylamino)ethyl]phenol

4-methyl-2-[1-(methylamino)ethyl]phenol (PubChem CID 43504566) has the molecular formula C10H15NO and a molecular weight of 165.24 g/mol. Its IUPAC name is 4-methyl-2-[1-(methylamino)ethyl]phenol.

Molecular Properties

Compound Name4-methyl-2-[1-(methylamino)ethyl]phenol
PubChem CID43504566
Molecular FormulaC10H15NO
Molecular Weight165.24 g/mol
Exact Mass165.12
IUPAC Name4-methyl-2-[1-(methylamino)ethyl]phenol
SMILESCNC(C)c1cc(C)ccc1O
InChIInChI=1S/C10H15NO/c1-7-4-5-10(12)9(6-7)8(2)11-3/h4-6,8,11-12H,1-3H3
InChIKeyUUGWFKBHAKBDLO-UHFFFAOYSA-N
XLogP1.98
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.24
LogP ≤ 51.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

4-methyl-2-[(1R)-1-(methylamino)ethyl]phenol
CID 55277105
4-chloro-2-[(1S)-1-(methylamino)ethyl]phenol
CID 94343743
4-methyl-2-[1,2,2-tris(2-hydroxy-5-methylphenyl)ethyl]phenol
CID 154108469
2-[(1R)-1-(methylamino)ethyl]-4-methylsulfanylphenol
CID 130639898
4-methyl-2-[1-(2,3,5-trifluoroanilino)ethyl]phenol
CID 62809968
3-[1-(2-hydroxy-5-methylphenyl)ethylamino]propane-1,2-diol
CID 66175463
2-[1-(2-methoxypropylamino)ethyl]-4-methylphenol
CID 102696431
4-methyl-2-[1-[[(1S)-1-pyridin-4-ylethyl]amino]ethyl]phenol
CID 81405986
4-methyl-2-[1-(4-methylphenyl)ethyl]phenol
CID 46930570
4-methyl-2-[1-(1-methylsulfinylpropan-2-ylamino)ethyl]phenol
CID 113429527
ethyl 2-[1-(2-hydroxy-5-methylphenyl)ethylamino]propanoate
CID 54960179
4-methyl-2-[1-[(3,3,5,5-tetramethylcyclohexyl)amino]ethyl]phenol
CID 103965620

Frequently Asked Questions

What is the IUPAC name of 4-methyl-2-[1-(methylamino)ethyl]phenol?
The IUPAC name of 4-methyl-2-[1-(methylamino)ethyl]phenol (CID 43504566) is 4-methyl-2-[1-(methylamino)ethyl]phenol.
What is the SMILES notation for 4-methyl-2-[1-(methylamino)ethyl]phenol?
The canonical SMILES for 4-methyl-2-[1-(methylamino)ethyl]phenol is CNC(C)c1cc(C)ccc1O.
What is the InChIKey of 4-methyl-2-[1-(methylamino)ethyl]phenol?
The InChIKey is UUGWFKBHAKBDLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15NO/c1-7-4-5-10(12)9(6-7)8(2)11-3/h4-6,8,11-12H,1-3H3.
What are the key properties of 4-methyl-2-[1-(methylamino)ethyl]phenol?
4-methyl-2-[1-(methylamino)ethyl]phenol has a molecular weight of 165.24 g/mol, XLogP of 1.98, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-2-[1-(methylamino)ethyl]phenol is sourced from PubChem (CID 43504566), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).