2-[4-[4-(2-hydroxyethyl)-N-[4-(2-hydroxyethyl)phenyl]anilino]phenyl]ethanol

C24H27NO3 — CID 20580135

IUPAC2-[4-[4-(2-hydroxyethyl)-N-[4-(2-hydroxyethyl)phenyl]anilino]phenyl]ethanol
SMILESOCCc1ccc(N(c2ccc(CCO)cc2)c2ccc(CCO)cc2)cc1
InChIInChI=1S/C24H27NO3/c26-16-13-19-1-7-22(8-2-19)25(23-9-3-20(4-10-23)14-17-27)24-11-5-21(6-12-24)15-18-28/h1-12,26-28H,13-18H2
InChIKeyRXENGLXQEJBWJL-UHFFFAOYSA-N
MW377.48 g/mol
LogP3.76
Rot. Bonds9

About 2-[4-[4-(2-hydroxyethyl)-N-[4-(2-hydroxyethyl)phenyl]anilino]phenyl]ethanol

2-[4-[4-(2-hydroxyethyl)-N-[4-(2-hydroxyethyl)phenyl]anilino]phenyl]ethanol (PubChem CID 20580135) has the molecular formula C24H27NO3 and a molecular weight of 377.48 g/mol. Its IUPAC name is 2-[4-[4-(2-hydroxyethyl)-N-[4-(2-hydroxyethyl)phenyl]anilino]phenyl]ethanol.

Molecular Properties

Compound Name2-[4-[4-(2-hydroxyethyl)-N-[4-(2-hydroxyethyl)phenyl]anilino]phenyl]ethanol
PubChem CID20580135
Molecular FormulaC24H27NO3
Molecular Weight377.48 g/mol
Exact Mass377.20
IUPAC Name2-[4-[4-(2-hydroxyethyl)-N-[4-(2-hydroxyethyl)phenyl]anilino]phenyl]ethanol
SMILESOCCc1ccc(N(c2ccc(CCO)cc2)c2ccc(CCO)cc2)cc1
InChIInChI=1S/C24H27NO3/c26-16-13-19-1-7-22(8-2-19)25(23-9-3-20(4-10-23)14-17-27)24-11-5-21(6-12-24)15-18-28/h1-12,26-28H,13-18H2
InChIKeyRXENGLXQEJBWJL-UHFFFAOYSA-N
XLogP3.76
TPSA63.93 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500377.48
LogP ≤ 53.76
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze 2-[4-[4-(2-hydroxyethyl)-N-[4-(2-hydroxyethyl)phenyl]anilino]phenyl]ethanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-[4-[4-(2-hydroxyethyl)-N-[4-(2-hydroxyethyl)phenyl]anilino]phenyl]ethanol?
The IUPAC name of 2-[4-[4-(2-hydroxyethyl)-N-[4-(2-hydroxyethyl)phenyl]anilino]phenyl]ethanol (CID 20580135) is 2-[4-[4-(2-hydroxyethyl)-N-[4-(2-hydroxyethyl)phenyl]anilino]phenyl]ethanol.
What is the SMILES notation for 2-[4-[4-(2-hydroxyethyl)-N-[4-(2-hydroxyethyl)phenyl]anilino]phenyl]ethanol?
The canonical SMILES for 2-[4-[4-(2-hydroxyethyl)-N-[4-(2-hydroxyethyl)phenyl]anilino]phenyl]ethanol is OCCc1ccc(N(c2ccc(CCO)cc2)c2ccc(CCO)cc2)cc1.
What is the InChIKey of 2-[4-[4-(2-hydroxyethyl)-N-[4-(2-hydroxyethyl)phenyl]anilino]phenyl]ethanol?
The InChIKey is RXENGLXQEJBWJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H27NO3/c26-16-13-19-1-7-22(8-2-19)25(23-9-3-20(4-10-23)14-17-27)24-11-5-21(6-12-24)15-18-28/h1-12,26-28H,13-18H2.
What are the key properties of 2-[4-[4-(2-hydroxyethyl)-N-[4-(2-hydroxyethyl)phenyl]anilino]phenyl]ethanol?
2-[4-[4-(2-hydroxyethyl)-N-[4-(2-hydroxyethyl)phenyl]anilino]phenyl]ethanol has a molecular weight of 377.48 g/mol, XLogP of 3.76, 9 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[4-(2-hydroxyethyl)-N-[4-(2-hydroxyethyl)phenyl]anilino]phenyl]ethanol is sourced from PubChem (CID 20580135), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).