2-[1-(4-pyridin-2-ylphenyl)ethenylamino]oxyethanol

C15H16N2O2 — CID 57323371

IUPAC2-[1-(4-pyridin-2-ylphenyl)ethenylamino]oxyethanol
SMILESC=C(NOCCO)c1ccc(-c2ccccn2)cc1
InChIInChI=1S/C15H16N2O2/c1-12(17-19-11-10-18)13-5-7-14(8-6-13)15-4-2-3-9-16-15/h2-9,17-18H,1,10-11H2
InChIKeyZDQFOZUHQNPGGQ-UHFFFAOYSA-N
MW256.30 g/mol
LogP2.23
Rot. Bonds6

About 2-[1-(4-pyridin-2-ylphenyl)ethenylamino]oxyethanol

2-[1-(4-pyridin-2-ylphenyl)ethenylamino]oxyethanol (PubChem CID 57323371) has the molecular formula C15H16N2O2 and a molecular weight of 256.30 g/mol. Its IUPAC name is 2-[1-(4-pyridin-2-ylphenyl)ethenylamino]oxyethanol.

Molecular Properties

Compound Name2-[1-(4-pyridin-2-ylphenyl)ethenylamino]oxyethanol
PubChem CID57323371
Molecular FormulaC15H16N2O2
Molecular Weight256.30 g/mol
Exact Mass256.12
IUPAC Name2-[1-(4-pyridin-2-ylphenyl)ethenylamino]oxyethanol
SMILESC=C(NOCCO)c1ccc(-c2ccccn2)cc1
InChIInChI=1S/C15H16N2O2/c1-12(17-19-11-10-18)13-5-7-14(8-6-13)15-4-2-3-9-16-15/h2-9,17-18H,1,10-11H2
InChIKeyZDQFOZUHQNPGGQ-UHFFFAOYSA-N
XLogP2.23
TPSA54.38 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.30
LogP ≤ 52.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-(ethylamino)-3-[4-[2-[1-(4-pyridin-2-ylphenyl)ethenylamino]oxyethoxy]phenyl]propanoic acid
CID 57067987
2-(4-methylphenoxy)-3-[4-[2-[1-(4-pyridin-2-ylphenyl)ethenylamino]oxyethoxy]phenyl]propanoic acid
CID 90815650
N-methyl-4-pyridin-2-ylbenzamide
CID 110464841
2-(2-pyridin-2-ylphenoxy)ethanol
CID 170698166
N-(2-amino-2-oxoethyl)-4-pyridin-2-ylbenzamide
CID 110473912
hexyl 4-pyridin-2-ylbenzoate
CID 132598707
N-(3-methoxypropyl)-4-pyridin-2-ylbenzamide
CID 110464861
N-propan-2-yl-4-pyridin-2-ylbenzamide
CID 59672619
hydrazine;2-phenylpyridine
CID 158673997
bis(iridium);tetrakis(4-pyridin-2-ylphenol)
CID 173084104
(4-pyridin-2-ylphenyl) 2-hydroxyacetate
CID 117051700
2-(4-pyridin-2-ylphenyl)acetamide
CID 57447645

Frequently Asked Questions

What is the IUPAC name of 2-[1-(4-pyridin-2-ylphenyl)ethenylamino]oxyethanol?
The IUPAC name of 2-[1-(4-pyridin-2-ylphenyl)ethenylamino]oxyethanol (CID 57323371) is 2-[1-(4-pyridin-2-ylphenyl)ethenylamino]oxyethanol.
What is the SMILES notation for 2-[1-(4-pyridin-2-ylphenyl)ethenylamino]oxyethanol?
The canonical SMILES for 2-[1-(4-pyridin-2-ylphenyl)ethenylamino]oxyethanol is C=C(NOCCO)c1ccc(-c2ccccn2)cc1.
What is the InChIKey of 2-[1-(4-pyridin-2-ylphenyl)ethenylamino]oxyethanol?
The InChIKey is ZDQFOZUHQNPGGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2O2/c1-12(17-19-11-10-18)13-5-7-14(8-6-13)15-4-2-3-9-16-15/h2-9,17-18H,1,10-11H2.
What are the key properties of 2-[1-(4-pyridin-2-ylphenyl)ethenylamino]oxyethanol?
2-[1-(4-pyridin-2-ylphenyl)ethenylamino]oxyethanol has a molecular weight of 256.30 g/mol, XLogP of 2.23, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(4-pyridin-2-ylphenyl)ethenylamino]oxyethanol is sourced from PubChem (CID 57323371), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).