2-[(E)-[(Z)-[(Z)-3-[4-(dimethylamino)phenyl]prop-2-enylidene]hydrazinylidene]methyl]phenol

C18H19N3O — CID 136795131

IUPAC2-[(E)-[(Z)-[(Z)-3-[4-(dimethylamino)phenyl]prop-2-enylidene]hydrazinylidene]methyl]phenol
SMILESCN(C)c1ccc(/C=C\C=N/N=C/c2ccccc2O)cc1
InChIInChI=1S/C18H19N3O/c1-21(2)17-11-9-15(10-12-17)6-5-13-19-20-14-16-7-3-4-8-18(16)22/h3-14,22H,1-2H3/b6-5-,19-13-,20-14+
InChIKeyWNHBKZGOPMDTJB-RUQZLZHDSA-N
MW293.37 g/mol
LogP3.58
Rot. Bonds5

About 2-[(E)-[(Z)-[(Z)-3-[4-(dimethylamino)phenyl]prop-2-enylidene]hydrazinylidene]methyl]phenol

2-[(E)-[(Z)-[(Z)-3-[4-(dimethylamino)phenyl]prop-2-enylidene]hydrazinylidene]methyl]phenol (PubChem CID 136795131) has the molecular formula C18H19N3O and a molecular weight of 293.37 g/mol. Its IUPAC name is 2-[(E)-[(Z)-[(Z)-3-[4-(dimethylamino)phenyl]prop-2-enylidene]hydrazinylidene]methyl]phenol.

Molecular Properties

Compound Name2-[(E)-[(Z)-[(Z)-3-[4-(dimethylamino)phenyl]prop-2-enylidene]hydrazinylidene]methyl]phenol
PubChem CID136795131
Molecular FormulaC18H19N3O
Molecular Weight293.37 g/mol
Exact Mass293.15
IUPAC Name2-[(E)-[(Z)-[(Z)-3-[4-(dimethylamino)phenyl]prop-2-enylidene]hydrazinylidene]methyl]phenol
SMILESCN(C)c1ccc(/C=C\C=N/N=C/c2ccccc2O)cc1
InChIInChI=1S/C18H19N3O/c1-21(2)17-11-9-15(10-12-17)6-5-13-19-20-14-16-7-3-4-8-18(16)22/h3-14,22H,1-2H3/b6-5-,19-13-,20-14+
InChIKeyWNHBKZGOPMDTJB-RUQZLZHDSA-N
XLogP3.58
TPSA48.19 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.37
LogP ≤ 53.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hzone_phenol_A(479)', 'substructure': 'N/A'}, {'alert_name': 'anil_di_alk_B(251)', 'substructure': 'N/A'}, {'alert_name': 'imine_imine_B(3)', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze 2-[(E)-[(Z)-[(Z)-3-[4-(dimethylamino)phenyl]prop-2-enylidene]hydrazinylidene]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

2-[(Z)-[(E)-[4-(dimethylamino)phenyl]methylidenehydrazinylidene]methyl]phenol
CID 135478785
2-[(E)-[(E)-[4-[(E)-[(E)-(2-hydroxyphenyl)methylidenehydrazinylidene]methyl]phenyl]methylidenehydrazinylidene]methyl]phenol
CID 135911153
(1E,4E)-1-[4-(dimethylamino)phenyl]-5-(2-hydroxyphenyl)penta-1,4-dien-3-one
CID 52936922
N,N-dimethyl-4-[(1E,3E,5E)-6-phenylhexa-1,3,5-trienyl]aniline
CID 6015156
N,N-dimethyl-4-[(1E,3E)-4-phenylbuta-1,3-dienyl]aniline
CID 10875699
2-[(E)-[[4-(dimethylamino)phenyl]-[(E)-(2-hydroxyphenyl)methylideneamino]methyl]iminomethyl]phenol
CID 177409649
[[(E)-3-[4-(dimethylamino)phenyl]prop-2-enylidene]amino] benzoate
CID 129438457
N,N-dimethyl-4-[(E)-2-[4-[(E)-2-phenylethenyl]phenyl]ethenyl]aniline
CID 132506209
4-chloro-2-[3-[4-(dimethylamino)phenyl]prop-2-enylideneamino]phenol
CID 166451731
4-[(Z)-2-[4-[(E)-2-[4-(dimethylamino)phenyl]ethenyl]phenyl]ethenyl]-N,N-dimethylaniline
CID 92530704
2-[(E)-[(Z)-(2-methylphenyl)methylidenehydrazinylidene]methyl]phenol
CID 135478768
2-[[(4-methoxyphenyl)methylidenehydrazinylidene]methyl]phenol
CID 3949149

Frequently Asked Questions

What is the IUPAC name of 2-[(E)-[(Z)-[(Z)-3-[4-(dimethylamino)phenyl]prop-2-enylidene]hydrazinylidene]methyl]phenol?
The IUPAC name of 2-[(E)-[(Z)-[(Z)-3-[4-(dimethylamino)phenyl]prop-2-enylidene]hydrazinylidene]methyl]phenol (CID 136795131) is 2-[(E)-[(Z)-[(Z)-3-[4-(dimethylamino)phenyl]prop-2-enylidene]hydrazinylidene]methyl]phenol.
What is the SMILES notation for 2-[(E)-[(Z)-[(Z)-3-[4-(dimethylamino)phenyl]prop-2-enylidene]hydrazinylidene]methyl]phenol?
The canonical SMILES for 2-[(E)-[(Z)-[(Z)-3-[4-(dimethylamino)phenyl]prop-2-enylidene]hydrazinylidene]methyl]phenol is CN(C)c1ccc(/C=C\C=N/N=C/c2ccccc2O)cc1.
What is the InChIKey of 2-[(E)-[(Z)-[(Z)-3-[4-(dimethylamino)phenyl]prop-2-enylidene]hydrazinylidene]methyl]phenol?
The InChIKey is WNHBKZGOPMDTJB-RUQZLZHDSA-N. The full InChI is InChI=1S/C18H19N3O/c1-21(2)17-11-9-15(10-12-17)6-5-13-19-20-14-16-7-3-4-8-18(16)22/h3-14,22H,1-2H3/b6-5-,19-13-,20-14+.
What are the key properties of 2-[(E)-[(Z)-[(Z)-3-[4-(dimethylamino)phenyl]prop-2-enylidene]hydrazinylidene]methyl]phenol?
2-[(E)-[(Z)-[(Z)-3-[4-(dimethylamino)phenyl]prop-2-enylidene]hydrazinylidene]methyl]phenol has a molecular weight of 293.37 g/mol, XLogP of 3.58, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(E)-[(Z)-[(Z)-3-[4-(dimethylamino)phenyl]prop-2-enylidene]hydrazinylidene]methyl]phenol is sourced from PubChem (CID 136795131), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).