4-[2-(dimethylamino)ethyl]-2-(2-hydroxyethyl)phenol

C12H19NO2 — CID 117299095

IUPAC4-[2-(dimethylamino)ethyl]-2-(2-hydroxyethyl)phenol
SMILESCN(C)CCc1ccc(O)c(CCO)c1
InChIInChI=1S/C12H19NO2/c1-13(2)7-5-10-3-4-12(15)11(9-10)6-8-14/h3-4,9,14-15H,5-8H2,1-2H3
InChIKeyPWDKNIZGBBHTDM-UHFFFAOYSA-N
MW209.29 g/mol
LogP1.03
Rot. Bonds5

About 4-[2-(dimethylamino)ethyl]-2-(2-hydroxyethyl)phenol

4-[2-(dimethylamino)ethyl]-2-(2-hydroxyethyl)phenol (PubChem CID 117299095) has the molecular formula C12H19NO2 and a molecular weight of 209.29 g/mol. Its IUPAC name is 4-[2-(dimethylamino)ethyl]-2-(2-hydroxyethyl)phenol.

Molecular Properties

Compound Name4-[2-(dimethylamino)ethyl]-2-(2-hydroxyethyl)phenol
PubChem CID117299095
Molecular FormulaC12H19NO2
Molecular Weight209.29 g/mol
Exact Mass209.14
IUPAC Name4-[2-(dimethylamino)ethyl]-2-(2-hydroxyethyl)phenol
SMILESCN(C)CCc1ccc(O)c(CCO)c1
InChIInChI=1S/C12H19NO2/c1-13(2)7-5-10-3-4-12(15)11(9-10)6-8-14/h3-4,9,14-15H,5-8H2,1-2H3
InChIKeyPWDKNIZGBBHTDM-UHFFFAOYSA-N
XLogP1.03
TPSA43.70 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.29
LogP ≤ 51.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 4-[2-(dimethylamino)ethyl]-2-(2-hydroxyethyl)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

4-[2-(dimethylamino)ethyl]-2-(3-hydroxypropyl)phenol
CID 117320433
4-[2-(dimethylamino)ethyl]benzene-1,2-diol;hydrobromide
CID 71442477
4-[2-(dimethylamino)ethyl]-2-[(methoxyamino)methyl]phenol
CID 117322399
4-[2-(dimethylamino)ethyl]-2-(1-hydroxycyclopropyl)phenol
CID 117316123
6-[2-(dimethylamino)ethyl]naphthalene-2,3-diol;hydrochloride
CID 20541926
2-(2-hydroxyethyl)-4-[[4-hydroxy-2-(2-hydroxyethyl)phenyl]methyl]phenol
CID 122513032
4-[2-[[bis(2-hydroxyethyl)amino]-methylamino]ethyl]benzene-1,2-diol
CID 173195865
2-(aminomethyl)-4-[2-(diethylamino)ethyl]phenol
CID 105479658
2-butyl-4-(2-trimethylsilylethyl)phenol
CID 150413765
4-[(dimethylamino)methyl]-2-octylphenol
CID 70503511
4-[3-(dimethylamino)propyl]-2-(morpholin-4-ylmethyl)phenol
CID 170866768
4-nonyl-2-pentylphenol
CID 86162849

Frequently Asked Questions

What is the IUPAC name of 4-[2-(dimethylamino)ethyl]-2-(2-hydroxyethyl)phenol?
The IUPAC name of 4-[2-(dimethylamino)ethyl]-2-(2-hydroxyethyl)phenol (CID 117299095) is 4-[2-(dimethylamino)ethyl]-2-(2-hydroxyethyl)phenol.
What is the SMILES notation for 4-[2-(dimethylamino)ethyl]-2-(2-hydroxyethyl)phenol?
The canonical SMILES for 4-[2-(dimethylamino)ethyl]-2-(2-hydroxyethyl)phenol is CN(C)CCc1ccc(O)c(CCO)c1.
What is the InChIKey of 4-[2-(dimethylamino)ethyl]-2-(2-hydroxyethyl)phenol?
The InChIKey is PWDKNIZGBBHTDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19NO2/c1-13(2)7-5-10-3-4-12(15)11(9-10)6-8-14/h3-4,9,14-15H,5-8H2,1-2H3.
What are the key properties of 4-[2-(dimethylamino)ethyl]-2-(2-hydroxyethyl)phenol?
4-[2-(dimethylamino)ethyl]-2-(2-hydroxyethyl)phenol has a molecular weight of 209.29 g/mol, XLogP of 1.03, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(dimethylamino)ethyl]-2-(2-hydroxyethyl)phenol is sourced from PubChem (CID 117299095), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).