3-[[2-(dimethylamino)anilino]methyl]phenol

C15H18N2O — CID 43726536

IUPAC3-[[2-(dimethylamino)anilino]methyl]phenol
SMILESCN(C)c1ccccc1NCc1cccc(O)c1
InChIInChI=1S/C15H18N2O/c1-17(2)15-9-4-3-8-14(15)16-11-12-6-5-7-13(18)10-12/h3-10,16,18H,11H2,1-2H3
InChIKeyZYXLABSJPBDROE-UHFFFAOYSA-N
MW242.32 g/mol
LogP3.07
Rot. Bonds4

About 3-[[2-(dimethylamino)anilino]methyl]phenol

3-[[2-(dimethylamino)anilino]methyl]phenol (PubChem CID 43726536) has the molecular formula C15H18N2O and a molecular weight of 242.32 g/mol. Its IUPAC name is 3-[[2-(dimethylamino)anilino]methyl]phenol.

Molecular Properties

Compound Name3-[[2-(dimethylamino)anilino]methyl]phenol
PubChem CID43726536
Molecular FormulaC15H18N2O
Molecular Weight242.32 g/mol
Exact Mass242.14
IUPAC Name3-[[2-(dimethylamino)anilino]methyl]phenol
SMILESCN(C)c1ccccc1NCc1cccc(O)c1
InChIInChI=1S/C15H18N2O/c1-17(2)15-9-4-3-8-14(15)16-11-12-6-5-7-13(18)10-12/h3-10,16,18H,11H2,1-2H3
InChIKeyZYXLABSJPBDROE-UHFFFAOYSA-N
XLogP3.07
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.32
LogP ≤ 53.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 3-[[2-(dimethylamino)anilino]methyl]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

1-N-[[3-(difluoromethyl)phenyl]methyl]-2-N,2-N-dimethylbenzene-1,2-diamine
CID 115526242
2-[[2-(dimethylamino)anilino]methyl]phenol
CID 43726496
3-[[2-(diethylaminomethyl)anilino]methyl]phenol
CID 43729325
1-N-[(3-fluoro-4-methylphenyl)methyl]-2-N,2-N-dimethylbenzene-1,2-diamine
CID 55226677
3-[(2-propoxyanilino)methyl]phenol
CID 43682286
N-[4-[[2-(dimethylamino)anilino]methyl]phenyl]acetamide
CID 43726479
2-[[2-(dimethylamino)anilino]methyl]-6-ethoxyphenol
CID 43726584
3-[(3-hydroxyanilino)methyl]phenol
CID 21321439
3-[(3-hydroxyphenyl)methylamino]-2-methylbenzamide
CID 43694119
3-[(3-hydroxyphenyl)methylamino]-N,2-dimethylbenzamide
CID 43734564
3-[[1-(dimethylamino)propan-2-ylamino]methyl]phenol
CID 82946106
3-[[2-(3-methyl-1,2,4-oxadiazol-5-yl)anilino]methyl]phenol
CID 43678229

Frequently Asked Questions

What is the IUPAC name of 3-[[2-(dimethylamino)anilino]methyl]phenol?
The IUPAC name of 3-[[2-(dimethylamino)anilino]methyl]phenol (CID 43726536) is 3-[[2-(dimethylamino)anilino]methyl]phenol.
What is the SMILES notation for 3-[[2-(dimethylamino)anilino]methyl]phenol?
The canonical SMILES for 3-[[2-(dimethylamino)anilino]methyl]phenol is CN(C)c1ccccc1NCc1cccc(O)c1.
What is the InChIKey of 3-[[2-(dimethylamino)anilino]methyl]phenol?
The InChIKey is ZYXLABSJPBDROE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O/c1-17(2)15-9-4-3-8-14(15)16-11-12-6-5-7-13(18)10-12/h3-10,16,18H,11H2,1-2H3.
What are the key properties of 3-[[2-(dimethylamino)anilino]methyl]phenol?
3-[[2-(dimethylamino)anilino]methyl]phenol has a molecular weight of 242.32 g/mol, XLogP of 3.07, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[[2-(dimethylamino)anilino]methyl]phenol is sourced from PubChem (CID 43726536), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).