tetrakis(4-methylpyridine);nickel

C24H28N4Ni — CID 160730254

IUPACtetrakis(4-methylpyridine);nickel
SMILESCc1ccncc1.Cc1ccncc1.Cc1ccncc1.Cc1ccncc1.[Ni]
InChIInChI=1S/4C6H7N.Ni/c4*1-6-2-4-7-5-3-6;/h4*2-5H,1H3;
InChIKeyRUFXIDLRCFYPFH-UHFFFAOYSA-N
MW431.21 g/mol
LogP5.56
Rot. Bonds

About tetrakis(4-methylpyridine);nickel

tetrakis(4-methylpyridine);nickel (PubChem CID 160730254) has the molecular formula C24H28N4Ni and a molecular weight of 431.21 g/mol. Its IUPAC name is tetrakis(4-methylpyridine);nickel.

Molecular Properties

Compound Nametetrakis(4-methylpyridine);nickel
PubChem CID160730254
Molecular FormulaC24H28N4Ni
Molecular Weight431.21 g/mol
Exact Mass430.17
IUPAC Nametetrakis(4-methylpyridine);nickel
SMILESCc1ccncc1.Cc1ccncc1.Cc1ccncc1.Cc1ccncc1.[Ni]
InChIInChI=1S/4C6H7N.Ni/c4*1-6-2-4-7-5-3-6;/h4*2-5H,1H3;
InChIKeyRUFXIDLRCFYPFH-UHFFFAOYSA-N
XLogP5.56
TPSA51.56 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500431.21
LogP ≤ 55.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

ethane;4-methylpyridine
CID 54305436
bis(4-methylpyridine);platinum(2+);dichloride
CID 170853957
deuterium monohydride;4-methylpyridine
CID 175130450
N,N-dimethylmethanamine;4-methylpyridine
CID 22155636
4-methylpyridine;4-pyridin-4-ylpyridine
CID 118057744
(E)-but-2-ene;4-methylpyridine;platinum(2+);dichloride
CID 171377193
isocyanic acid;4-methylpyridine
CID 174958459
formic acid;4-methylpyridine
CID 162172361
4-methylpyridine;sulfuric acid
CID 71383556
4-methylpyridine;thiophene
CID 145224941
acetic acid;iron;tris(4-methylpyridine);hydrate
CID 44661385
bis(4-methylpyridine);1,2,4,5-tetrafluoro-3,6-diiodobenzene
CID 139178587

Frequently Asked Questions

What is the IUPAC name of tetrakis(4-methylpyridine);nickel?
The IUPAC name of tetrakis(4-methylpyridine);nickel (CID 160730254) is tetrakis(4-methylpyridine);nickel.
What is the SMILES notation for tetrakis(4-methylpyridine);nickel?
The canonical SMILES for tetrakis(4-methylpyridine);nickel is Cc1ccncc1.Cc1ccncc1.Cc1ccncc1.Cc1ccncc1.[Ni].
What is the InChIKey of tetrakis(4-methylpyridine);nickel?
The InChIKey is RUFXIDLRCFYPFH-UHFFFAOYSA-N. The full InChI is InChI=1S/4C6H7N.Ni/c4*1-6-2-4-7-5-3-6;/h4*2-5H,1H3;.
What are the key properties of tetrakis(4-methylpyridine);nickel?
tetrakis(4-methylpyridine);nickel has a molecular weight of 431.21 g/mol, XLogP of 5.56, 0 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for tetrakis(4-methylpyridine);nickel is sourced from PubChem (CID 160730254), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).