4-[(2E)-2-[(4-pyridin-3-yloxyphenyl)methylidene]hydrazinyl]phenol

C18H15N3O2 — CID 143199920

IUPAC4-[(2E)-2-[(4-pyridin-3-yloxyphenyl)methylidene]hydrazinyl]phenol
SMILESOc1ccc(N/N=C/c2ccc(Oc3cccnc3)cc2)cc1
InChIInChI=1S/C18H15N3O2/c22-16-7-5-15(6-8-16)21-20-12-14-3-9-17(10-4-14)23-18-2-1-11-19-13-18/h1-13,21-22H/b20-12+
InChIKeyRWJJBBDAJUTURH-UDWIEESQSA-N
MW305.34 g/mol
LogP4.03
Rot. Bonds5

About 4-[(2E)-2-[(4-pyridin-3-yloxyphenyl)methylidene]hydrazinyl]phenol

4-[(2E)-2-[(4-pyridin-3-yloxyphenyl)methylidene]hydrazinyl]phenol (PubChem CID 143199920) has the molecular formula C18H15N3O2 and a molecular weight of 305.34 g/mol. Its IUPAC name is 4-[(2E)-2-[(4-pyridin-3-yloxyphenyl)methylidene]hydrazinyl]phenol.

Molecular Properties

Compound Name4-[(2E)-2-[(4-pyridin-3-yloxyphenyl)methylidene]hydrazinyl]phenol
PubChem CID143199920
Molecular FormulaC18H15N3O2
Molecular Weight305.34 g/mol
Exact Mass305.12
IUPAC Name4-[(2E)-2-[(4-pyridin-3-yloxyphenyl)methylidene]hydrazinyl]phenol
SMILESOc1ccc(N/N=C/c2ccc(Oc3cccnc3)cc2)cc1
InChIInChI=1S/C18H15N3O2/c22-16-7-5-15(6-8-16)21-20-12-14-3-9-17(10-4-14)23-18-2-1-11-19-13-18/h1-13,21-22H/b20-12+
InChIKeyRWJJBBDAJUTURH-UDWIEESQSA-N
XLogP4.03
TPSA66.74 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.34
LogP ≤ 54.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydroquinone', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

4-[(E)-[(4-methoxyphenyl)hydrazinylidene]methyl]phenol
CID 135510327
[4-[(phenylhydrazinylidene)methyl]phenyl] pyridine-3-carboxylate
CID 3277359
N-[(Z)-pyridin-3-ylmethylideneamino]aniline
CID 5375484
N-[[4-(4-fluorophenoxy)phenyl]methylideneamino]aniline
CID 169381600
4-[(Z)-[(4-bromophenyl)hydrazinylidene]methyl]phenol
CID 135891453
aminourea;4-fluorobenzaldehyde;pyridin-3-ol;4-pyridin-3-yloxybenzaldehyde;[(E)-(4-pyridin-3-yloxyphenyl)methylideneamino]urea
CID 172945705
4-[[(4-chlorophenyl)hydrazinylidene]methyl]phenol;hydrochloride
CID 136666048
4-methyl-N-(pyridin-3-ylmethylideneamino)aniline
CID 5175441
[4-[(Z)-(naphthalen-2-ylhydrazinylidene)methyl]phenyl] pyridine-3-carboxylate
CID 6266025
N-[[4-(3,5-dimethylphenoxy)phenyl]methylideneamino]aniline
CID 110840192
(NE,S)-2-methyl-N-[(4-pyridin-3-yloxyphenyl)methylidene]propane-2-sulfinamide
CID 163337745
N-[(4-bromophenyl)methylideneamino]-4-(4-chlorophenoxy)aniline
CID 167431722

Frequently Asked Questions

What is the IUPAC name of 4-[(2E)-2-[(4-pyridin-3-yloxyphenyl)methylidene]hydrazinyl]phenol?
The IUPAC name of 4-[(2E)-2-[(4-pyridin-3-yloxyphenyl)methylidene]hydrazinyl]phenol (CID 143199920) is 4-[(2E)-2-[(4-pyridin-3-yloxyphenyl)methylidene]hydrazinyl]phenol.
What is the SMILES notation for 4-[(2E)-2-[(4-pyridin-3-yloxyphenyl)methylidene]hydrazinyl]phenol?
The canonical SMILES for 4-[(2E)-2-[(4-pyridin-3-yloxyphenyl)methylidene]hydrazinyl]phenol is Oc1ccc(N/N=C/c2ccc(Oc3cccnc3)cc2)cc1.
What is the InChIKey of 4-[(2E)-2-[(4-pyridin-3-yloxyphenyl)methylidene]hydrazinyl]phenol?
The InChIKey is RWJJBBDAJUTURH-UDWIEESQSA-N. The full InChI is InChI=1S/C18H15N3O2/c22-16-7-5-15(6-8-16)21-20-12-14-3-9-17(10-4-14)23-18-2-1-11-19-13-18/h1-13,21-22H/b20-12+.
What are the key properties of 4-[(2E)-2-[(4-pyridin-3-yloxyphenyl)methylidene]hydrazinyl]phenol?
4-[(2E)-2-[(4-pyridin-3-yloxyphenyl)methylidene]hydrazinyl]phenol has a molecular weight of 305.34 g/mol, XLogP of 4.03, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(2E)-2-[(4-pyridin-3-yloxyphenyl)methylidene]hydrazinyl]phenol is sourced from PubChem (CID 143199920), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).