3-[3-[(2-phenylhydrazinyl)methyl]phenyl]phenol

C19H18N2O — CID 169385182

IUPAC3-[3-[(2-phenylhydrazinyl)methyl]phenyl]phenol
SMILESOc1cccc(-c2cccc(CNNc3ccccc3)c2)c1
InChIInChI=1S/C19H18N2O/c22-19-11-5-8-17(13-19)16-7-4-6-15(12-16)14-20-21-18-9-2-1-3-10-18/h1-13,20-22H,14H2
InChIKeyUSRLXNSTRQRXGE-UHFFFAOYSA-N
MW290.37 g/mol
LogP4.18
Rot. Bonds5

About 3-[3-[(2-phenylhydrazinyl)methyl]phenyl]phenol

3-[3-[(2-phenylhydrazinyl)methyl]phenyl]phenol (PubChem CID 169385182) has the molecular formula C19H18N2O and a molecular weight of 290.37 g/mol. Its IUPAC name is 3-[3-[(2-phenylhydrazinyl)methyl]phenyl]phenol.

Molecular Properties

Compound Name3-[3-[(2-phenylhydrazinyl)methyl]phenyl]phenol
PubChem CID169385182
Molecular FormulaC19H18N2O
Molecular Weight290.37 g/mol
Exact Mass290.14
IUPAC Name3-[3-[(2-phenylhydrazinyl)methyl]phenyl]phenol
SMILESOc1cccc(-c2cccc(CNNc3ccccc3)c2)c1
InChIInChI=1S/C19H18N2O/c22-19-11-5-8-17(13-19)16-7-4-6-15(12-16)14-20-21-18-9-2-1-3-10-18/h1-13,20-22H,14H2
InChIKeyUSRLXNSTRQRXGE-UHFFFAOYSA-N
XLogP4.18
TPSA44.29 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.37
LogP ≤ 54.18
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 3-[3-[(2-phenylhydrazinyl)methyl]phenyl]phenol?
The IUPAC name of 3-[3-[(2-phenylhydrazinyl)methyl]phenyl]phenol (CID 169385182) is 3-[3-[(2-phenylhydrazinyl)methyl]phenyl]phenol.
What is the SMILES notation for 3-[3-[(2-phenylhydrazinyl)methyl]phenyl]phenol?
The canonical SMILES for 3-[3-[(2-phenylhydrazinyl)methyl]phenyl]phenol is Oc1cccc(-c2cccc(CNNc3ccccc3)c2)c1.
What is the InChIKey of 3-[3-[(2-phenylhydrazinyl)methyl]phenyl]phenol?
The InChIKey is USRLXNSTRQRXGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N2O/c22-19-11-5-8-17(13-19)16-7-4-6-15(12-16)14-20-21-18-9-2-1-3-10-18/h1-13,20-22H,14H2.
What are the key properties of 3-[3-[(2-phenylhydrazinyl)methyl]phenyl]phenol?
3-[3-[(2-phenylhydrazinyl)methyl]phenyl]phenol has a molecular weight of 290.37 g/mol, XLogP of 4.18, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[3-[(2-phenylhydrazinyl)methyl]phenyl]phenol is sourced from PubChem (CID 169385182), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).