[6-[(5-methylpyrazol-1-id-3-yl)methyl]pyrazin-2-yl]methanamine;1-[[6-[(5-methylpyrazol-1-id-3-yl)methyl]pyrazin-2-yl]methyl]-3-phenyl-2H-imidazo[4,5-b]pyridin-2-ide;3-phenyl-1,2-dihydroimidazo[4,5-b]pyridin-2-ide;platinum

C44H39N15Pt2-6 — CID 170690866

IUPAC[6-[(5-methylpyrazol-1-id-3-yl)methyl]pyrazin-2-yl]methanamine;1-[[6-[(5-methylpyrazol-1-id-3-yl)methyl]pyrazin-2-yl]methyl]-3-phenyl-2H-imidazo[4,5-b]pyridin-2-ide;3-phenyl-1,2-dihydroimidazo[4,5-b]pyridin-2-ide;platinum
SMILESCc1cc(Cc2cncc(CN)n2)n[n-]1.Cc1cc(Cc2cncc(CN3[CH-]N(c4[c-]cccc4)c4ncccc43)n2)n[n-]1.[Pt].[Pt].[c-]1ccccc1N1[CH-]Nc2cccnc21
InChIInChI=1S/C22H18N7.C12H9N3.C10H12N5.2Pt/c1-16-10-17(27-26-16)11-18-12-23-13-19(25-18)14-28-15-29(20-6-3-2-4-7-20)22-21(28)8-5-9-24-22;1-2-5-10(6-3-1)15-9-14-11-7-4-8-13-12(11)15;1-7-2-8(15-14-7)3-9-5-12-6-10(4-11)13-9;;/h2-6,8-10,12-13,15H,11,14H2,1H3;1-5,7-9,14H;2,5-6H,3-4,11H2,1H3;;/q-3;-2;-1;;
InChIKeyXUBSBWCUSPVGJN-UHFFFAOYSA-N
MW1168.06 g/mol
LogP5.95
Rot. Bonds9

About [6-[(5-methylpyrazol-1-id-3-yl)methyl]pyrazin-2-yl]methanamine;1-[[6-[(5-methylpyrazol-1-id-3-yl)methyl]pyrazin-2-yl]methyl]-3-phenyl-2H-imidazo[4,5-b]pyridin-2-ide;3-phenyl-1,2-dihydroimidazo[4,5-b]pyridin-2-ide;platinum

[6-[(5-methylpyrazol-1-id-3-yl)methyl]pyrazin-2-yl]methanamine;1-[[6-[(5-methylpyrazol-1-id-3-yl)methyl]pyrazin-2-yl]methyl]-3-phenyl-2H-imidazo[4,5-b]pyridin-2-ide;3-phenyl-1,2-dihydroimidazo[4,5-b]pyridin-2-ide;platinum (PubChem CID 170690866) has the molecular formula C44H39N15Pt2-6 and a molecular weight of 1168.06 g/mol. Its IUPAC name is [6-[(5-methylpyrazol-1-id-3-yl)methyl]pyrazin-2-yl]methanamine;1-[[6-[(5-methylpyrazol-1-id-3-yl)methyl]pyrazin-2-yl]methyl]-3-phenyl-2H-imidazo[4,5-b]pyridin-2-ide;3-phenyl-1,2-dihydroimidazo[4,5-b]pyridin-2-ide;platinum.

Molecular Properties

Compound Name[6-[(5-methylpyrazol-1-id-3-yl)methyl]pyrazin-2-yl]methanamine;1-[[6-[(5-methylpyrazol-1-id-3-yl)methyl]pyrazin-2-yl]methyl]-3-phenyl-2H-imidazo[4,5-b]pyridin-2-ide;3-phenyl-1,2-dihydroimidazo[4,5-b]pyridin-2-ide;platinum
PubChem CID170690866
Molecular FormulaC44H39N15Pt2-6
Molecular Weight1168.06 g/mol
Exact Mass1167.28
IUPAC Name[6-[(5-methylpyrazol-1-id-3-yl)methyl]pyrazin-2-yl]methanamine;1-[[6-[(5-methylpyrazol-1-id-3-yl)methyl]pyrazin-2-yl]methyl]-3-phenyl-2H-imidazo[4,5-b]pyridin-2-ide;3-phenyl-1,2-dihydroimidazo[4,5-b]pyridin-2-ide;platinum
SMILESCc1cc(Cc2cncc(CN)n2)n[n-]1.Cc1cc(Cc2cncc(CN3[CH-]N(c4[c-]cccc4)c4ncccc43)n2)n[n-]1.[Pt].[Pt].[c-]1ccccc1N1[CH-]Nc2cccnc21
InChIInChI=1S/C22H18N7.C12H9N3.C10H12N5.2Pt/c1-16-10-17(27-26-16)11-18-12-23-13-19(25-18)14-28-15-29(20-6-3-2-4-7-20)22-21(28)8-5-9-24-22;1-2-5-10(6-3-1)15-9-14-11-7-4-8-13-12(11)15;1-7-2-8(15-14-7)3-9-5-12-6-10(4-11)13-9;;/h2-6,8-10,12-13,15H,11,14H2,1H3;1-5,7-9,14H;2,5-6H,3-4,11H2,1H3;;/q-3;-2;-1;;
InChIKeyXUBSBWCUSPVGJN-UHFFFAOYSA-N
XLogP5.95
TPSA179.09 Ų
H-Bond Donors2
H-Bond Acceptors13
Rotatable Bonds9
Heavy Atoms61
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001168.06
LogP ≤ 55.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 1013

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of [6-[(5-methylpyrazol-1-id-3-yl)methyl]pyrazin-2-yl]methanamine;1-[[6-[(5-methylpyrazol-1-id-3-yl)methyl]pyrazin-2-yl]methyl]-3-phenyl-2H-imidazo[4,5-b]pyridin-2-ide;3-phenyl-1,2-dihydroimidazo[4,5-b]pyridin-2-ide;platinum?
The IUPAC name of [6-[(5-methylpyrazol-1-id-3-yl)methyl]pyrazin-2-yl]methanamine;1-[[6-[(5-methylpyrazol-1-id-3-yl)methyl]pyrazin-2-yl]methyl]-3-phenyl-2H-imidazo[4,5-b]pyridin-2-ide;3-phenyl-1,2-dihydroimidazo[4,5-b]pyridin-2-ide;platinum (CID 170690866) is [6-[(5-methylpyrazol-1-id-3-yl)methyl]pyrazin-2-yl]methanamine;1-[[6-[(5-methylpyrazol-1-id-3-yl)methyl]pyrazin-2-yl]methyl]-3-phenyl-2H-imidazo[4,5-b]pyridin-2-ide;3-phenyl-1,2-dihydroimidazo[4,5-b]pyridin-2-ide;platinum.
What is the SMILES notation for [6-[(5-methylpyrazol-1-id-3-yl)methyl]pyrazin-2-yl]methanamine;1-[[6-[(5-methylpyrazol-1-id-3-yl)methyl]pyrazin-2-yl]methyl]-3-phenyl-2H-imidazo[4,5-b]pyridin-2-ide;3-phenyl-1,2-dihydroimidazo[4,5-b]pyridin-2-ide;platinum?
The canonical SMILES for [6-[(5-methylpyrazol-1-id-3-yl)methyl]pyrazin-2-yl]methanamine;1-[[6-[(5-methylpyrazol-1-id-3-yl)methyl]pyrazin-2-yl]methyl]-3-phenyl-2H-imidazo[4,5-b]pyridin-2-ide;3-phenyl-1,2-dihydroimidazo[4,5-b]pyridin-2-ide;platinum is Cc1cc(Cc2cncc(CN)n2)n[n-]1.Cc1cc(Cc2cncc(CN3[CH-]N(c4[c-]cccc4)c4ncccc43)n2)n[n-]1.[Pt].[Pt].[c-]1ccccc1N1[CH-]Nc2cccnc21.
What is the InChIKey of [6-[(5-methylpyrazol-1-id-3-yl)methyl]pyrazin-2-yl]methanamine;1-[[6-[(5-methylpyrazol-1-id-3-yl)methyl]pyrazin-2-yl]methyl]-3-phenyl-2H-imidazo[4,5-b]pyridin-2-ide;3-phenyl-1,2-dihydroimidazo[4,5-b]pyridin-2-ide;platinum?
The InChIKey is XUBSBWCUSPVGJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H18N7.C12H9N3.C10H12N5.2Pt/c1-16-10-17(27-26-16)11-18-12-23-13-19(25-18)14-28-15-29(20-6-3-2-4-7-20)22-21(28)8-5-9-24-22;1-2-5-10(6-3-1)15-9-14-11-7-4-8-13-12(11)15;1-7-2-8(15-14-7)3-9-5-12-6-10(4-11)13-9;;/h2-6,8-10,12-13,15H,11,14H2,1H3;1-5,7-9,14H;2,5-6H,3-4,11H2,1H3;;/q-3;-2;-1;;.
What are the key properties of [6-[(5-methylpyrazol-1-id-3-yl)methyl]pyrazin-2-yl]methanamine;1-[[6-[(5-methylpyrazol-1-id-3-yl)methyl]pyrazin-2-yl]methyl]-3-phenyl-2H-imidazo[4,5-b]pyridin-2-ide;3-phenyl-1,2-dihydroimidazo[4,5-b]pyridin-2-ide;platinum?
[6-[(5-methylpyrazol-1-id-3-yl)methyl]pyrazin-2-yl]methanamine;1-[[6-[(5-methylpyrazol-1-id-3-yl)methyl]pyrazin-2-yl]methyl]-3-phenyl-2H-imidazo[4,5-b]pyridin-2-ide;3-phenyl-1,2-dihydroimidazo[4,5-b]pyridin-2-ide;platinum has a molecular weight of 1168.06 g/mol, XLogP of 5.95, 9 rotatable bonds, 2 hydrogen bond donors, and 13 hydrogen bond acceptors.
Where does this data come from?
All data for [6-[(5-methylpyrazol-1-id-3-yl)methyl]pyrazin-2-yl]methanamine;1-[[6-[(5-methylpyrazol-1-id-3-yl)methyl]pyrazin-2-yl]methyl]-3-phenyl-2H-imidazo[4,5-b]pyridin-2-ide;3-phenyl-1,2-dihydroimidazo[4,5-b]pyridin-2-ide;platinum is sourced from PubChem (CID 170690866), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).