4-(4-fluorophenyl)-2-[(2-phenylhydrazinyl)methyl]phenol

C19H17FN2O — CID 169387199

IUPAC4-(4-fluorophenyl)-2-[(2-phenylhydrazinyl)methyl]phenol
SMILESOc1ccc(-c2ccc(F)cc2)cc1CNNc1ccccc1
InChIInChI=1S/C19H17FN2O/c20-17-9-6-14(7-10-17)15-8-11-19(23)16(12-15)13-21-22-18-4-2-1-3-5-18/h1-12,21-23H,13H2
InChIKeyHOZODJMJYNHNFG-UHFFFAOYSA-N
MW308.36 g/mol
LogP4.32
Rot. Bonds5

About 4-(4-fluorophenyl)-2-[(2-phenylhydrazinyl)methyl]phenol

4-(4-fluorophenyl)-2-[(2-phenylhydrazinyl)methyl]phenol (PubChem CID 169387199) has the molecular formula C19H17FN2O and a molecular weight of 308.36 g/mol. Its IUPAC name is 4-(4-fluorophenyl)-2-[(2-phenylhydrazinyl)methyl]phenol.

Molecular Properties

Compound Name4-(4-fluorophenyl)-2-[(2-phenylhydrazinyl)methyl]phenol
PubChem CID169387199
Molecular FormulaC19H17FN2O
Molecular Weight308.36 g/mol
Exact Mass308.13
IUPAC Name4-(4-fluorophenyl)-2-[(2-phenylhydrazinyl)methyl]phenol
SMILESOc1ccc(-c2ccc(F)cc2)cc1CNNc1ccccc1
InChIInChI=1S/C19H17FN2O/c20-17-9-6-14(7-10-17)15-8-11-19(23)16(12-15)13-21-22-18-4-2-1-3-5-18/h1-12,21-23H,13H2
InChIKeyHOZODJMJYNHNFG-UHFFFAOYSA-N
XLogP4.32
TPSA44.29 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.36
LogP ≤ 54.32
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'mannich_A(296)', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

CYP144A1 ligand, 3
CID 126842851
5-(sec-butyl)-2-hydroxybenzaldehyde N-phenylhydrazone
CID 564882
2-(4-hydroxy-3-prop-2-enylphenyl)-6-[(E)-(phenylhydrazinylidene)methyl]-4-prop-2-enylphenol
CID 136123421
Benzaldehyde, 2-hydroxy-5-(1-methylpropyl)-, phenylhydrazone
CID 135472991
4-Hydroxy
CID 12028131
4-[(4-Fluorophenyl)methyl]-2-[3-(hydroxyamino)phenyl]phenol
CID 88245357
4-[(4-Amino-2,6-dimethylphenyl)methyl]-2-[(4-fluorophenyl)methyl]phenol
CID 141155753
4-[(4-Amino-2,6-dimethylphenyl)methyl]-2-[1-(4-fluorophenyl)ethyl]phenol
CID 162522728
4-(1-Adamantyl)-2-[[(4-fluorophenyl)hydrazinylidene]methyl]phenol
CID 175824482
4-(1-Adamantyl)-2-[[(3-fluorophenyl)hydrazinylidene]methyl]phenol
CID 175824490
4-(1-Adamantyl)-2-[[(2-fluorophenyl)hydrazinylidene]methyl]phenol
CID 175824509
4-[2-(4-Hydroxyphenyl)-1,2-bis(2-phenylhydrazinyl)ethyl]phenol
CID 12561013

Frequently Asked Questions

What is the IUPAC name of 4-(4-fluorophenyl)-2-[(2-phenylhydrazinyl)methyl]phenol?
The IUPAC name of 4-(4-fluorophenyl)-2-[(2-phenylhydrazinyl)methyl]phenol (CID 169387199) is 4-(4-fluorophenyl)-2-[(2-phenylhydrazinyl)methyl]phenol.
What is the SMILES notation for 4-(4-fluorophenyl)-2-[(2-phenylhydrazinyl)methyl]phenol?
The canonical SMILES for 4-(4-fluorophenyl)-2-[(2-phenylhydrazinyl)methyl]phenol is Oc1ccc(-c2ccc(F)cc2)cc1CNNc1ccccc1.
What is the InChIKey of 4-(4-fluorophenyl)-2-[(2-phenylhydrazinyl)methyl]phenol?
The InChIKey is HOZODJMJYNHNFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17FN2O/c20-17-9-6-14(7-10-17)15-8-11-19(23)16(12-15)13-21-22-18-4-2-1-3-5-18/h1-12,21-23H,13H2.
What are the key properties of 4-(4-fluorophenyl)-2-[(2-phenylhydrazinyl)methyl]phenol?
4-(4-fluorophenyl)-2-[(2-phenylhydrazinyl)methyl]phenol has a molecular weight of 308.36 g/mol, XLogP of 4.32, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-fluorophenyl)-2-[(2-phenylhydrazinyl)methyl]phenol is sourced from PubChem (CID 169387199), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).