dichlorocobalt;N-[2,6-di(propan-2-yl)phenyl]-1-(6-phenyl-2-pyridinyl)methanimine

C24H26Cl2CoN2 — CID 59444818

IUPACdichlorocobalt;N-[2,6-di(propan-2-yl)phenyl]-1-(6-phenyl-2-pyridinyl)methanimine
SMILESCC(C)c1cccc(C(C)C)c1/N=C/c1cccc(-c2ccccc2)n1.Cl[Co]Cl
InChIInChI=1S/C24H26N2.2ClH.Co/c1-17(2)21-13-9-14-22(18(3)4)24(21)25-16-20-12-8-15-23(26-20)19-10-6-5-7-11-19;;;/h5-18H,1-4H3;2*1H;/q;;;+2/p-2/b25-16+;;;
InChIKeyXVBUACAXQJDIMR-JDVRIFNQSA-L
MW472.33 g/mol
LogP8.12
Rot. Bonds5

About dichlorocobalt;N-[2,6-di(propan-2-yl)phenyl]-1-(6-phenyl-2-pyridinyl)methanimine

dichlorocobalt;N-[2,6-di(propan-2-yl)phenyl]-1-(6-phenyl-2-pyridinyl)methanimine (PubChem CID 59444818) has the molecular formula C24H26Cl2CoN2 and a molecular weight of 472.33 g/mol. Its IUPAC name is dichlorocobalt;N-[2,6-di(propan-2-yl)phenyl]-1-(6-phenyl-2-pyridinyl)methanimine.

Molecular Properties

Compound Namedichlorocobalt;N-[2,6-di(propan-2-yl)phenyl]-1-(6-phenyl-2-pyridinyl)methanimine
PubChem CID59444818
Molecular FormulaC24H26Cl2CoN2
Molecular Weight472.33 g/mol
Exact Mass471.08
IUPAC Namedichlorocobalt;N-[2,6-di(propan-2-yl)phenyl]-1-(6-phenyl-2-pyridinyl)methanimine
SMILESCC(C)c1cccc(C(C)C)c1/N=C/c1cccc(-c2ccccc2)n1.Cl[Co]Cl
InChIInChI=1S/C24H26N2.2ClH.Co/c1-17(2)21-13-9-14-22(18(3)4)24(21)25-16-20-12-8-15-23(26-20)19-10-6-5-7-11-19;;;/h5-18H,1-4H3;2*1H;/q;;;+2/p-2/b25-16+;;;
InChIKeyXVBUACAXQJDIMR-JDVRIFNQSA-L
XLogP8.12
TPSA25.25 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500472.33
LogP ≤ 58.12
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

2-[6-[[2,6-di(propan-2-yl)phenyl]iminomethyl]-2-pyridinyl]-6-phenylphenol
CID 136726129
N-[2,6-di(propan-2-yl)phenyl]-1-(6-naphthalen-1-yl-2-pyridinyl)methanimine
CID 12070562
N-[2,6-di(propan-2-yl)phenyl]-1-[6-(6-pyridin-2-yl-2-pyridinyl)-2-pyridinyl]methanimine
CID 101384973
1-(4-butyl-6-phenyl-2-pyridinyl)-N-[2,6-di(propan-2-yl)phenyl]methanimine
CID 102492718
tris(dichlorocobalt);1-[6-(2,6-dimethylphenyl)-2-pyridinyl]-N-[2,6-di(propan-2-yl)phenyl]methanimine;N-[2,6-di(propan-2-yl)phenyl]-1-(6-naphthalen-1-yl-2-pyridinyl)ethanimine;N-[2,6-di(propan-2-yl)phenyl]-1-(6-naphthalen-1-yl-2-pyridinyl)methanimine
CID 158989069
tetrakis(N-[2,6-di(propan-2-yl)phenyl]-1-pyridin-2-ylmethanimine);zinc
CID 139116950
N-[[1-[6-[[2,6-di(propan-2-yl)phenyl]iminomethyl]-2-pyridinyl]naphthalen-2-yl]methyl]-2-methylaniline
CID 66799583
carbanide;N-[2,6-di(propan-2-yl)phenyl]-1-pyridin-2-ylmethanimine;iron(2+)
CID 147504192
1-(2,5-diphenyl-1,3-oxazol-4-yl)-N-[2,6-di(propan-2-yl)phenyl]methanimine
CID 58932997
N-[2,6-di(propan-2-yl)phenyl]-1-[6-[(2R)-2-methyl-2,3-dihydro-1H-indol-7-yl]-2-pyridinyl]methanimine
CID 159677459
N-[2,6-di(propan-2-yl)phenyl]-1-[6-[[2,6-di(propan-2-yl)phenyl]iminomethyl]-4-methyl-2-pyridinyl]methanimine;neodymium(3+);trichloride
CID 173243069
N-[2,6-di(propan-2-yl)phenyl]-1-(2-methyl-1,3-thiazol-4-yl)methanimine
CID 58933058

Frequently Asked Questions

What is the IUPAC name of dichlorocobalt;N-[2,6-di(propan-2-yl)phenyl]-1-(6-phenyl-2-pyridinyl)methanimine?
The IUPAC name of dichlorocobalt;N-[2,6-di(propan-2-yl)phenyl]-1-(6-phenyl-2-pyridinyl)methanimine (CID 59444818) is dichlorocobalt;N-[2,6-di(propan-2-yl)phenyl]-1-(6-phenyl-2-pyridinyl)methanimine.
What is the SMILES notation for dichlorocobalt;N-[2,6-di(propan-2-yl)phenyl]-1-(6-phenyl-2-pyridinyl)methanimine?
The canonical SMILES for dichlorocobalt;N-[2,6-di(propan-2-yl)phenyl]-1-(6-phenyl-2-pyridinyl)methanimine is CC(C)c1cccc(C(C)C)c1/N=C/c1cccc(-c2ccccc2)n1.Cl[Co]Cl.
What is the InChIKey of dichlorocobalt;N-[2,6-di(propan-2-yl)phenyl]-1-(6-phenyl-2-pyridinyl)methanimine?
The InChIKey is XVBUACAXQJDIMR-JDVRIFNQSA-L. The full InChI is InChI=1S/C24H26N2.2ClH.Co/c1-17(2)21-13-9-14-22(18(3)4)24(21)25-16-20-12-8-15-23(26-20)19-10-6-5-7-11-19;;;/h5-18H,1-4H3;2*1H;/q;;;+2/p-2/b25-16+;;;.
What are the key properties of dichlorocobalt;N-[2,6-di(propan-2-yl)phenyl]-1-(6-phenyl-2-pyridinyl)methanimine?
dichlorocobalt;N-[2,6-di(propan-2-yl)phenyl]-1-(6-phenyl-2-pyridinyl)methanimine has a molecular weight of 472.33 g/mol, XLogP of 8.12, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for dichlorocobalt;N-[2,6-di(propan-2-yl)phenyl]-1-(6-phenyl-2-pyridinyl)methanimine is sourced from PubChem (CID 59444818), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).