platinum;6-[[3-(pyridin-2-ylmethyl)benzene-2-id-1-yl]methyl]pyridine-2-carboxylic acid

C19H15N2O2Pt- — CID 58709017

IUPACplatinum;6-[[3-(pyridin-2-ylmethyl)benzene-2-id-1-yl]methyl]pyridine-2-carboxylic acid
SMILESO=C(O)c1cccc(Cc2[c-]c(Cc3ccccn3)ccc2)n1.[Pt]
InChIInChI=1S/C19H15N2O2.Pt/c22-19(23)18-9-4-8-17(21-18)13-15-6-3-5-14(11-15)12-16-7-1-2-10-20-16;/h1-10H,12-13H2,(H,22,23);/q-1;
InChIKeyBHMUOFSIXVEWNG-UHFFFAOYSA-N
MW498.42 g/mol
LogP3.15
Rot. Bonds5

About platinum;6-[[3-(pyridin-2-ylmethyl)benzene-2-id-1-yl]methyl]pyridine-2-carboxylic acid

platinum;6-[[3-(pyridin-2-ylmethyl)benzene-2-id-1-yl]methyl]pyridine-2-carboxylic acid (PubChem CID 58709017) has the molecular formula C19H15N2O2Pt- and a molecular weight of 498.42 g/mol. Its IUPAC name is platinum;6-[[3-(pyridin-2-ylmethyl)benzene-2-id-1-yl]methyl]pyridine-2-carboxylic acid.

Molecular Properties

Compound Nameplatinum;6-[[3-(pyridin-2-ylmethyl)benzene-2-id-1-yl]methyl]pyridine-2-carboxylic acid
PubChem CID58709017
Molecular FormulaC19H15N2O2Pt-
Molecular Weight498.42 g/mol
Exact Mass498.08
IUPAC Nameplatinum;6-[[3-(pyridin-2-ylmethyl)benzene-2-id-1-yl]methyl]pyridine-2-carboxylic acid
SMILESO=C(O)c1cccc(Cc2[c-]c(Cc3ccccn3)ccc2)n1.[Pt]
InChIInChI=1S/C19H15N2O2.Pt/c22-19(23)18-9-4-8-17(21-18)13-15-6-3-5-14(11-15)12-16-7-1-2-10-20-16;/h1-10H,12-13H2,(H,22,23);/q-1;
InChIKeyBHMUOFSIXVEWNG-UHFFFAOYSA-N
XLogP3.15
TPSA63.08 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500498.42
LogP ≤ 53.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

Chromium tripicolinate
CID 56840998
Chromium picolinate monohydrate
CID 22833491
Bis(2-(4,6-difluorophenyl)pyridinato-C2,N)(picolinato)iridium(III)
CID 71306701
1,6-Naphthyridine-2-carboxylic acid
CID 735908
[3,4'-Bipyridine]-2'-carboxylic acid
CID 46316068
CU-Pda-pic
CID 133065582
(4,4'-Bipyridine)-2-carboxylic acid
CID 46316069
[3,3'-Bipyridine]-6-carboxylic acid
CID 46316070
(2,3'-Bipyridine)-2'-carboxylic acid
CID 67843457
Indolizine-5-carboxylic acid
CID 83679019
tris(picolinato)manganese(II)
CID 163710
Chromium-picolinate
CID 625469

Frequently Asked Questions

What is the IUPAC name of platinum;6-[[3-(pyridin-2-ylmethyl)benzene-2-id-1-yl]methyl]pyridine-2-carboxylic acid?
The IUPAC name of platinum;6-[[3-(pyridin-2-ylmethyl)benzene-2-id-1-yl]methyl]pyridine-2-carboxylic acid (CID 58709017) is platinum;6-[[3-(pyridin-2-ylmethyl)benzene-2-id-1-yl]methyl]pyridine-2-carboxylic acid.
What is the SMILES notation for platinum;6-[[3-(pyridin-2-ylmethyl)benzene-2-id-1-yl]methyl]pyridine-2-carboxylic acid?
The canonical SMILES for platinum;6-[[3-(pyridin-2-ylmethyl)benzene-2-id-1-yl]methyl]pyridine-2-carboxylic acid is O=C(O)c1cccc(Cc2[c-]c(Cc3ccccn3)ccc2)n1.[Pt].
What is the InChIKey of platinum;6-[[3-(pyridin-2-ylmethyl)benzene-2-id-1-yl]methyl]pyridine-2-carboxylic acid?
The InChIKey is BHMUOFSIXVEWNG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15N2O2.Pt/c22-19(23)18-9-4-8-17(21-18)13-15-6-3-5-14(11-15)12-16-7-1-2-10-20-16;/h1-10H,12-13H2,(H,22,23);/q-1;.
What are the key properties of platinum;6-[[3-(pyridin-2-ylmethyl)benzene-2-id-1-yl]methyl]pyridine-2-carboxylic acid?
platinum;6-[[3-(pyridin-2-ylmethyl)benzene-2-id-1-yl]methyl]pyridine-2-carboxylic acid has a molecular weight of 498.42 g/mol, XLogP of 3.15, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for platinum;6-[[3-(pyridin-2-ylmethyl)benzene-2-id-1-yl]methyl]pyridine-2-carboxylic acid is sourced from PubChem (CID 58709017), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).