2-[3-methoxypropyl(methyl)amino]phenol

C11H17NO2 — CID 134473103

IUPAC2-[3-methoxypropyl(methyl)amino]phenol
SMILESCOCCCN(C)c1ccccc1O
InChIInChI=1S/C11H17NO2/c1-12(8-5-9-14-2)10-6-3-4-7-11(10)13/h3-4,6-7,13H,5,8-9H2,1-2H3
InChIKeyZRIUIADUEAKWQH-UHFFFAOYSA-N
MW195.26 g/mol
LogP1.86
Rot. Bonds5

About 2-[3-methoxypropyl(methyl)amino]phenol

2-[3-methoxypropyl(methyl)amino]phenol (PubChem CID 134473103) has the molecular formula C11H17NO2 and a molecular weight of 195.26 g/mol. Its IUPAC name is 2-[3-methoxypropyl(methyl)amino]phenol.

Molecular Properties

Compound Name2-[3-methoxypropyl(methyl)amino]phenol
PubChem CID134473103
Molecular FormulaC11H17NO2
Molecular Weight195.26 g/mol
Exact Mass195.13
IUPAC Name2-[3-methoxypropyl(methyl)amino]phenol
SMILESCOCCCN(C)c1ccccc1O
InChIInChI=1S/C11H17NO2/c1-12(8-5-9-14-2)10-6-3-4-7-11(10)13/h3-4,6-7,13H,5,8-9H2,1-2H3
InChIKeyZRIUIADUEAKWQH-UHFFFAOYSA-N
XLogP1.86
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.26
LogP ≤ 51.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 2-[3-methoxypropyl(methyl)amino]phenol 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-[3-ethoxypropyl(methyl)amino]phenol
CID 18006894
1-[2-[3-methoxypropyl(methyl)amino]phenyl]propan-1-ol
CID 112678949
2-[(1R)-1-aminoethyl]-N-(3-methoxypropyl)-N-methylaniline
CID 78935486
3-N-(3-methoxypropyl)-3-N,2-dimethylbenzene-1,3-diamine
CID 63062749
N-(3-methoxypropyl)-N-methyl-2-(propylaminomethyl)aniline
CID 55141079
2-amino-3-[3-methoxypropyl(methyl)amino]benzoic acid
CID 115545998
2-(aminomethyl)-3-fluoro-N-(3-methoxypropyl)-N-methylaniline
CID 79517799
2-hydroxy-N-(3-methoxypropyl)-N-methylbenzenesulfonamide
CID 81246026
N-(3-methoxypropyl)-N-methyl-2-[1-(propylamino)propyl]aniline
CID 115995187
[4-[3-methoxypropyl(methyl)amino]quinolin-2-yl]methanol
CID 63375970
2-bromo-N'-hydroxy-6-[3-methoxypropyl(methyl)amino]benzenecarboximidamide
CID 114883251
1-[2-[2-methoxyethyl(methyl)amino]phenyl]ethanone
CID 61427259

Frequently Asked Questions

What is the IUPAC name of 2-[3-methoxypropyl(methyl)amino]phenol?
The IUPAC name of 2-[3-methoxypropyl(methyl)amino]phenol (CID 134473103) is 2-[3-methoxypropyl(methyl)amino]phenol.
What is the SMILES notation for 2-[3-methoxypropyl(methyl)amino]phenol?
The canonical SMILES for 2-[3-methoxypropyl(methyl)amino]phenol is COCCCN(C)c1ccccc1O.
What is the InChIKey of 2-[3-methoxypropyl(methyl)amino]phenol?
The InChIKey is ZRIUIADUEAKWQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17NO2/c1-12(8-5-9-14-2)10-6-3-4-7-11(10)13/h3-4,6-7,13H,5,8-9H2,1-2H3.
What are the key properties of 2-[3-methoxypropyl(methyl)amino]phenol?
2-[3-methoxypropyl(methyl)amino]phenol has a molecular weight of 195.26 g/mol, XLogP of 1.86, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-methoxypropyl(methyl)amino]phenol is sourced from PubChem (CID 134473103), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).