4-(4-anilino-N-methylanilino)phenol

C19H18N2O — CID 143031995

IUPAC4-(4-anilino-N-methylanilino)phenol
SMILESCN(c1ccc(O)cc1)c1ccc(Nc2ccccc2)cc1
InChIInChI=1S/C19H18N2O/c1-21(18-11-13-19(22)14-12-18)17-9-7-16(8-10-17)20-15-5-3-2-4-6-15/h2-14,20,22H,1H3
InChIKeyYMZVODGTDLWENM-UHFFFAOYSA-N
MW290.37 g/mol
LogP4.90
Rot. Bonds4

About 4-(4-anilino-N-methylanilino)phenol

4-(4-anilino-N-methylanilino)phenol (PubChem CID 143031995) has the molecular formula C19H18N2O and a molecular weight of 290.37 g/mol. Its IUPAC name is 4-(4-anilino-N-methylanilino)phenol.

Molecular Properties

Compound Name4-(4-anilino-N-methylanilino)phenol
PubChem CID143031995
Molecular FormulaC19H18N2O
Molecular Weight290.37 g/mol
Exact Mass290.14
IUPAC Name4-(4-anilino-N-methylanilino)phenol
SMILESCN(c1ccc(O)cc1)c1ccc(Nc2ccccc2)cc1
InChIInChI=1S/C19H18N2O/c1-21(18-11-13-19(22)14-12-18)17-9-7-16(8-10-17)20-15-5-3-2-4-6-15/h2-14,20,22H,1H3
InChIKeyYMZVODGTDLWENM-UHFFFAOYSA-N
XLogP4.90
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.37
LogP ≤ 54.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 4-(4-anilino-N-methylanilino)phenol 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 4-(4-anilino-N-methylanilino)phenol?
The IUPAC name of 4-(4-anilino-N-methylanilino)phenol (CID 143031995) is 4-(4-anilino-N-methylanilino)phenol.
What is the SMILES notation for 4-(4-anilino-N-methylanilino)phenol?
The canonical SMILES for 4-(4-anilino-N-methylanilino)phenol is CN(c1ccc(O)cc1)c1ccc(Nc2ccccc2)cc1.
What is the InChIKey of 4-(4-anilino-N-methylanilino)phenol?
The InChIKey is YMZVODGTDLWENM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N2O/c1-21(18-11-13-19(22)14-12-18)17-9-7-16(8-10-17)20-15-5-3-2-4-6-15/h2-14,20,22H,1H3.
What are the key properties of 4-(4-anilino-N-methylanilino)phenol?
4-(4-anilino-N-methylanilino)phenol has a molecular weight of 290.37 g/mol, XLogP of 4.90, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-anilino-N-methylanilino)phenol is sourced from PubChem (CID 143031995), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).