N-(2,6-diethylphenyl)-1-pyridin-2-ylethanimine;nickel(2+)

C17H20N2Ni+2 — CID 158562372

IUPACN-(2,6-diethylphenyl)-1-pyridin-2-ylethanimine;nickel(2+)
SMILESCCc1cccc(CC)c1/N=C(\C)c1ccccn1.[Ni+2]
InChIInChI=1S/C17H20N2.Ni/c1-4-14-9-8-10-15(5-2)17(14)19-13(3)16-11-6-7-12-18-16;/h6-12H,4-5H2,1-3H3;/q;+2/b19-13+;
InChIKeyHRAUHUAUOLBECZ-XTWSRORZSA-N
MW311.05 g/mol
LogP4.34
Rot. Bonds4

About N-(2,6-diethylphenyl)-1-pyridin-2-ylethanimine;nickel(2+)

N-(2,6-diethylphenyl)-1-pyridin-2-ylethanimine;nickel(2+) (PubChem CID 158562372) has the molecular formula C17H20N2Ni+2 and a molecular weight of 311.05 g/mol. Its IUPAC name is N-(2,6-diethylphenyl)-1-pyridin-2-ylethanimine;nickel(2+).

Molecular Properties

Compound NameN-(2,6-diethylphenyl)-1-pyridin-2-ylethanimine;nickel(2+)
PubChem CID158562372
Molecular FormulaC17H20N2Ni+2
Molecular Weight311.05 g/mol
Exact Mass310.10
IUPAC NameN-(2,6-diethylphenyl)-1-pyridin-2-ylethanimine;nickel(2+)
SMILESCCc1cccc(CC)c1/N=C(\C)c1ccccn1.[Ni+2]
InChIInChI=1S/C17H20N2.Ni/c1-4-14-9-8-10-15(5-2)17(14)19-13(3)16-11-6-7-12-18-16;/h6-12H,4-5H2,1-3H3;/q;+2/b19-13+;
InChIKeyHRAUHUAUOLBECZ-XTWSRORZSA-N
XLogP4.34
TPSA25.25 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.05
LogP ≤ 54.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Related Compounds

cobalt(3+);N-(2,6-diethylphenyl)-1-[6-[N-(2,6-diethylphenyl)-C-methylcarbonimidoyl]-2-pyridinyl]ethanimine;trichloride
CID 173242790
3-(2,6-diethylphenyl)imino-1-pyridin-2-ylbutan-1-one
CID 141062715
N-(2,6-dibromophenyl)-1-pyridin-2-ylethanimine
CID 141267824
cobalt(3+);N-(2,6-diethylphenyl)-1-[6-[N-(2,6-diethylphenyl)-C-methylcarbonimidoyl]-4-methyl-2-pyridinyl]ethanimine;trichloride
CID 173244594
N-(2,6-diethyl-4-methylphenyl)-1-[6-[N-(2,6-diethyl-4-methylphenyl)-C-methylcarbonimidoyl]-2-pyridinyl]ethanimine;iron(3+);trichloride
CID 173243949
N-(2,6-diethyl-4-methylphenyl)-1-[6-[N-(2,6-diethyl-4-methylphenyl)-C-methylcarbonimidoyl]-2-pyridinyl]ethanimine;vanadium(2+);dichloride
CID 173243023
cobalt;N-(2-ethylphenyl)-1-[6-[N-(2-ethylphenyl)-C-methylcarbonimidoyl]-2-pyridinyl]ethanimine;dihydrobromide
CID 175255082
N-(4-chlorophenyl)-1-pyridin-2-ylethanimine
CID 15815211
palladium(2+);bis(2-(1-pyridin-2-ylethylideneamino)benzenethiolate)
CID 10650522
N-(2-ethyl-6-propan-2-ylphenyl)-1-phenyl-1-pyridin-2-ylmethanimine
CID 142056339
N-methyl-1-pyridin-2-ylethanimine
CID 12970828
N-(2,6-diethylphenyl)pyridine-2-carboxamide
CID 19224278

Frequently Asked Questions

What is the IUPAC name of N-(2,6-diethylphenyl)-1-pyridin-2-ylethanimine;nickel(2+)?
The IUPAC name of N-(2,6-diethylphenyl)-1-pyridin-2-ylethanimine;nickel(2+) (CID 158562372) is N-(2,6-diethylphenyl)-1-pyridin-2-ylethanimine;nickel(2+).
What is the SMILES notation for N-(2,6-diethylphenyl)-1-pyridin-2-ylethanimine;nickel(2+)?
The canonical SMILES for N-(2,6-diethylphenyl)-1-pyridin-2-ylethanimine;nickel(2+) is CCc1cccc(CC)c1/N=C(\C)c1ccccn1.[Ni+2].
What is the InChIKey of N-(2,6-diethylphenyl)-1-pyridin-2-ylethanimine;nickel(2+)?
The InChIKey is HRAUHUAUOLBECZ-XTWSRORZSA-N. The full InChI is InChI=1S/C17H20N2.Ni/c1-4-14-9-8-10-15(5-2)17(14)19-13(3)16-11-6-7-12-18-16;/h6-12H,4-5H2,1-3H3;/q;+2/b19-13+;.
What are the key properties of N-(2,6-diethylphenyl)-1-pyridin-2-ylethanimine;nickel(2+)?
N-(2,6-diethylphenyl)-1-pyridin-2-ylethanimine;nickel(2+) has a molecular weight of 311.05 g/mol, XLogP of 4.34, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-diethylphenyl)-1-pyridin-2-ylethanimine;nickel(2+) is sourced from PubChem (CID 158562372), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).