bis(3-(1,5-dimethylimidazol-4-yl)-4H-pyridin-4-ide);platinum(2+)

C20H20N6Pt — CID 58401802

IUPACbis(3-(1,5-dimethylimidazol-4-yl)-4H-pyridin-4-ide);platinum(2+)
SMILESCc1c(-c2[c-]ccnc2)ncn1C.Cc1c(-c2[c-]ccnc2)ncn1C.[Pt+2]
InChIInChI=1S/2C10H10N3.Pt/c2*1-8-10(12-7-13(8)2)9-4-3-5-11-6-9;/h2*3,5-7H,1-2H3;/q2*-1;+2
InChIKeyRGPZUKFYPBTDMD-UHFFFAOYSA-N
MW539.50 g/mol
LogP3.18
Rot. Bonds2

About bis(3-(1,5-dimethylimidazol-4-yl)-4H-pyridin-4-ide);platinum(2+)

bis(3-(1,5-dimethylimidazol-4-yl)-4H-pyridin-4-ide);platinum(2+) (PubChem CID 58401802) has the molecular formula C20H20N6Pt and a molecular weight of 539.50 g/mol. Its IUPAC name is bis(3-(1,5-dimethylimidazol-4-yl)-4H-pyridin-4-ide);platinum(2+).

Molecular Properties

Compound Namebis(3-(1,5-dimethylimidazol-4-yl)-4H-pyridin-4-ide);platinum(2+)
PubChem CID58401802
Molecular FormulaC20H20N6Pt
Molecular Weight539.50 g/mol
Exact Mass539.14
IUPAC Namebis(3-(1,5-dimethylimidazol-4-yl)-4H-pyridin-4-ide);platinum(2+)
SMILESCc1c(-c2[c-]ccnc2)ncn1C.Cc1c(-c2[c-]ccnc2)ncn1C.[Pt+2]
InChIInChI=1S/2C10H10N3.Pt/c2*1-8-10(12-7-13(8)2)9-4-3-5-11-6-9;/h2*3,5-7H,1-2H3;/q2*-1;+2
InChIKeyRGPZUKFYPBTDMD-UHFFFAOYSA-N
XLogP3.18
TPSA61.42 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500539.50
LogP ≤ 53.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

Bis(5-methyl-4-(2-methylbenzene-6-id-1-yl)-1-(2,2,2-trifluoroethyl)imidazole);platinum(2+)
CID 59661443
1,5-Dimethyl-4-phenylimidazole;iridium
CID 57596136
Bis(1,5-dimethyl-4-(2-methylbenzene-6-id-1-yl)imidazole);platinum(2+)
CID 58401570
Tris(1,5-dimethyl-4-(2-methylbenzene-6-id-1-yl)imidazole);iridium(3+)
CID 58401703
2-(2-methylbenzene-6-id-1-yl)-4-propan-2-yl-4H-imidazole;4-(2-methylbenzene-6-id-1-yl)-1-propan-2-ylimidazole;platinum(2+)
CID 58401774
Bis(4-(2,4-dimethylbenzene-6-id-1-yl)-1-methylimidazole);platinum(2+)
CID 58401799
bis(3-methyl-5,9-dihydro-4H-benzo[e]benzimidazol-9-ide);platinum(2+)
CID 58401857
Bis(1,2-dimethyl-4-(2-methylbenzene-6-id-1-yl)imidazole);platinum(2+)
CID 58401867
tris(3-(1,5-dimethylimidazol-4-yl)-4H-pyridin-4-ide);iridium(3+)
CID 58401904
Bis(1,5-dimethyl-4-phenylimidazole);platinum(2+)
CID 58401905
Bis(4-(2-methylbenzene-6-id-1-yl)-1-propan-2-ylimidazole);platinum(2+)
CID 59661369
1,5-Dimethyl-4-(2-methylbenzene-6-id-1-yl)imidazole;4,5-dimethyl-1-(2-methylbenzene-6-id-1-yl)-1,2,4-triazol-4-ium;platinum(2+)
CID 59661517

Frequently Asked Questions

What is the IUPAC name of bis(3-(1,5-dimethylimidazol-4-yl)-4H-pyridin-4-ide);platinum(2+)?
The IUPAC name of bis(3-(1,5-dimethylimidazol-4-yl)-4H-pyridin-4-ide);platinum(2+) (CID 58401802) is bis(3-(1,5-dimethylimidazol-4-yl)-4H-pyridin-4-ide);platinum(2+).
What is the SMILES notation for bis(3-(1,5-dimethylimidazol-4-yl)-4H-pyridin-4-ide);platinum(2+)?
The canonical SMILES for bis(3-(1,5-dimethylimidazol-4-yl)-4H-pyridin-4-ide);platinum(2+) is Cc1c(-c2[c-]ccnc2)ncn1C.Cc1c(-c2[c-]ccnc2)ncn1C.[Pt+2].
What is the InChIKey of bis(3-(1,5-dimethylimidazol-4-yl)-4H-pyridin-4-ide);platinum(2+)?
The InChIKey is RGPZUKFYPBTDMD-UHFFFAOYSA-N. The full InChI is InChI=1S/2C10H10N3.Pt/c2*1-8-10(12-7-13(8)2)9-4-3-5-11-6-9;/h2*3,5-7H,1-2H3;/q2*-1;+2.
What are the key properties of bis(3-(1,5-dimethylimidazol-4-yl)-4H-pyridin-4-ide);platinum(2+)?
bis(3-(1,5-dimethylimidazol-4-yl)-4H-pyridin-4-ide);platinum(2+) has a molecular weight of 539.50 g/mol, XLogP of 3.18, 2 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for bis(3-(1,5-dimethylimidazol-4-yl)-4H-pyridin-4-ide);platinum(2+) is sourced from PubChem (CID 58401802), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).