N-[7-(8H-naphthalen-8-id-1-yl)-8H-naphthalen-8-id-1-yl]-1-phenylmethanimine;platinum

C27H16NPt-3 — CID 58233129

IUPACN-[7-(8H-naphthalen-8-id-1-yl)-8H-naphthalen-8-id-1-yl]-1-phenylmethanimine;platinum
SMILES[Pt].[c-]1ccccc1/C=N/c1cccc2ccc(-c3cccc4ccc[c-]c34)[c-]c12
InChIInChI=1S/C27H16N.Pt/c1-2-8-20(9-3-1)19-28-27-15-7-12-22-16-17-23(18-26(22)27)25-14-6-11-21-10-4-5-13-24(21)25;/h1-8,10-12,14-17,19H;/q-3;/b28-19+;
InChIKeyRDVZMDCNAFARPP-SOQZJLQASA-N
MW549.51 g/mol
LogP6.81
Rot. Bonds3

About N-[7-(8H-naphthalen-8-id-1-yl)-8H-naphthalen-8-id-1-yl]-1-phenylmethanimine;platinum

N-[7-(8H-naphthalen-8-id-1-yl)-8H-naphthalen-8-id-1-yl]-1-phenylmethanimine;platinum (PubChem CID 58233129) has the molecular formula C27H16NPt-3 and a molecular weight of 549.51 g/mol. Its IUPAC name is N-[7-(8H-naphthalen-8-id-1-yl)-8H-naphthalen-8-id-1-yl]-1-phenylmethanimine;platinum.

Molecular Properties

Compound NameN-[7-(8H-naphthalen-8-id-1-yl)-8H-naphthalen-8-id-1-yl]-1-phenylmethanimine;platinum
PubChem CID58233129
Molecular FormulaC27H16NPt-3
Molecular Weight549.51 g/mol
Exact Mass549.09
IUPAC NameN-[7-(8H-naphthalen-8-id-1-yl)-8H-naphthalen-8-id-1-yl]-1-phenylmethanimine;platinum
SMILES[Pt].[c-]1ccccc1/C=N/c1cccc2ccc(-c3cccc4ccc[c-]c34)[c-]c12
InChIInChI=1S/C27H16N.Pt/c1-2-8-20(9-3-1)19-28-27-15-7-12-22-16-17-23(18-26(22)27)25-14-6-11-21-10-4-5-13-24(21)25;/h1-8,10-12,14-17,19H;/q-3;/b28-19+;
InChIKeyRDVZMDCNAFARPP-SOQZJLQASA-N
XLogP6.81
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms29
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500549.51
LogP ≤ 56.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

palladium(2+);1-phenyl-N-(7-quinolin-8-yl-8H-naphthalen-8-id-1-yl)methanimine
CID 58233159
N-[7-(8H-naphthalen-8-id-1-yl)-8H-naphthalen-8-id-1-yl]-1-pyridin-2-ylmethanimine;platinum(2+)
CID 58233097
1-isoquinolin-1-yl-N-[7-(8H-naphthalen-8-id-1-yl)-8H-naphthalen-8-id-1-yl]methanimine;palladium(2+)
CID 58233232
1-isoquinolin-1-yl-N-[7-(8H-naphthalen-8-id-1-yl)-8H-naphthalen-8-id-1-yl]methanimine;platinum(2+)
CID 58233135
carbanide;1-phenyl-N-[2-(phenylmethylideneamino)phenyl]methanimine;platinum
CID 162490671
1-(1H-naphthalen-1-id-2-yl)-N-(7-quinolin-8-yl-8H-naphthalen-8-id-1-yl)methanimine;platinum(2+)
CID 58233176
lithium 8-naphthalen-1-yl-1H-naphthalen-1-ide
CID 177406030
1-(3-isoquinolin-1-ylbenzene-2-id-1-yl)-N-(1-phenylnaphthalen-2-yl)methanimine;palladium(2+)
CID 58233109
[(Z)-2-phenylethenyl]benzene
CID 101447651
benzaldehyde;carbanide;tungsten(2+)
CID 20660194
10H-benzo[h]quinolin-10-ide;2-pyridin-2-ylphenol;quinolin-8-ol;rhenium
CID 135973441
8-(trifluoromethyl)-1H-naphthalen-1-ide;yttrium
CID 166533772

Frequently Asked Questions

What is the IUPAC name of N-[7-(8H-naphthalen-8-id-1-yl)-8H-naphthalen-8-id-1-yl]-1-phenylmethanimine;platinum?
The IUPAC name of N-[7-(8H-naphthalen-8-id-1-yl)-8H-naphthalen-8-id-1-yl]-1-phenylmethanimine;platinum (CID 58233129) is N-[7-(8H-naphthalen-8-id-1-yl)-8H-naphthalen-8-id-1-yl]-1-phenylmethanimine;platinum.
What is the SMILES notation for N-[7-(8H-naphthalen-8-id-1-yl)-8H-naphthalen-8-id-1-yl]-1-phenylmethanimine;platinum?
The canonical SMILES for N-[7-(8H-naphthalen-8-id-1-yl)-8H-naphthalen-8-id-1-yl]-1-phenylmethanimine;platinum is [Pt].[c-]1ccccc1/C=N/c1cccc2ccc(-c3cccc4ccc[c-]c34)[c-]c12.
What is the InChIKey of N-[7-(8H-naphthalen-8-id-1-yl)-8H-naphthalen-8-id-1-yl]-1-phenylmethanimine;platinum?
The InChIKey is RDVZMDCNAFARPP-SOQZJLQASA-N. The full InChI is InChI=1S/C27H16N.Pt/c1-2-8-20(9-3-1)19-28-27-15-7-12-22-16-17-23(18-26(22)27)25-14-6-11-21-10-4-5-13-24(21)25;/h1-8,10-12,14-17,19H;/q-3;/b28-19+;.
What are the key properties of N-[7-(8H-naphthalen-8-id-1-yl)-8H-naphthalen-8-id-1-yl]-1-phenylmethanimine;platinum?
N-[7-(8H-naphthalen-8-id-1-yl)-8H-naphthalen-8-id-1-yl]-1-phenylmethanimine;platinum has a molecular weight of 549.51 g/mol, XLogP of 6.81, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[7-(8H-naphthalen-8-id-1-yl)-8H-naphthalen-8-id-1-yl]-1-phenylmethanimine;platinum is sourced from PubChem (CID 58233129), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).