chloropalladium(1+);2-(5-methylpyrazol-2-id-3-yl)-6-pyridin-2-yloxypyridine

C14H11ClN4OPd — CID 140729239

IUPACchloropalladium(1+);2-(5-methylpyrazol-2-id-3-yl)-6-pyridin-2-yloxypyridine
SMILESCc1cc(-c2cccc(Oc3ccccn3)n2)[n-]n1.Cl[Pd+]
InChIInChI=1S/C14H11N4O.ClH.Pd/c1-10-9-12(18-17-10)11-5-4-7-14(16-11)19-13-6-2-3-8-15-13;;/h2-9H,1H3;1H;/q-1;;+2/p-1
InChIKeyBLODRFASDADUGV-UHFFFAOYSA-M
MW393.14 g/mol
LogP3.28
Rot. Bonds3

About chloropalladium(1+);2-(5-methylpyrazol-2-id-3-yl)-6-pyridin-2-yloxypyridine

chloropalladium(1+);2-(5-methylpyrazol-2-id-3-yl)-6-pyridin-2-yloxypyridine (PubChem CID 140729239) has the molecular formula C14H11ClN4OPd and a molecular weight of 393.14 g/mol. Its IUPAC name is chloropalladium(1+);2-(5-methylpyrazol-2-id-3-yl)-6-pyridin-2-yloxypyridine.

Molecular Properties

Compound Namechloropalladium(1+);2-(5-methylpyrazol-2-id-3-yl)-6-pyridin-2-yloxypyridine
PubChem CID140729239
Molecular FormulaC14H11ClN4OPd
Molecular Weight393.14 g/mol
Exact Mass391.97
IUPAC Namechloropalladium(1+);2-(5-methylpyrazol-2-id-3-yl)-6-pyridin-2-yloxypyridine
SMILESCc1cc(-c2cccc(Oc3ccccn3)n2)[n-]n1.Cl[Pd+]
InChIInChI=1S/C14H11N4O.ClH.Pd/c1-10-9-12(18-17-10)11-5-4-7-14(16-11)19-13-6-2-3-8-15-13;;/h2-9H,1H3;1H;/q-1;;+2/p-1
InChIKeyBLODRFASDADUGV-UHFFFAOYSA-M
XLogP3.28
TPSA62.00 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500393.14
LogP ≤ 53.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2-(5-Methylpyrazol-2-id-3-yl)-6-[[6-[3-(trifluoromethyl)pyrazol-1-id-5-yl]-2-pyridinyl]oxy]pyridine;platinum(2+)
CID 58831058
Platinum(2+);2-(3-pyridin-2-yloxybenzene-2-id-1-yl)oxypyridine;2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine
CID 164849078
3-(2,4-Difluorobenzene-6-id-1-yl)-6-methoxypyridazine;platinum(2+);2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine
CID 168793695
3-Methoxy-6-phenylpyridazine;platinum(2+);2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine
CID 168793709
3-Methoxy-6-(4-methoxybenzene-6-id-1-yl)pyridazine;platinum(2+);2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine
CID 168793717
3-(4-Fluorobenzene-6-id-1-yl)-6-methoxypyridazine;platinum(2+);2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine
CID 168793722
7-(6-Ethoxy-3-pyridazinyl)pyrazolo[1,5-a]pyridine
CID 56919160
4-[2-(6-Ethoxy-pyridin-2-yl)-pyrazolo[1,5-a]pyridin-3-yl]-quinoline
CID 10474077
N,N-dimethyl-4-[[4-(2-pyridin-2-yl-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-3-yl)-2-pyridinyl]oxy]butan-1-amine
CID 21992599
2-ethoxy-4-(2-pyridin-2-yl-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-3-yl)quinoline
CID 21992763
Platinum(2+);2-pyrazol-2-id-3-yl-6-[(6-pyrazol-2-id-3-yl-2-pyridinyl)oxy]pyridine
CID 57796282
Chloroplatinum(1+);2-[3-(3,5-dimethylpyrazol-1-yl)benzene-2-id-1-yl]oxypyridine
CID 58130253

Frequently Asked Questions

What is the IUPAC name of chloropalladium(1+);2-(5-methylpyrazol-2-id-3-yl)-6-pyridin-2-yloxypyridine?
The IUPAC name of chloropalladium(1+);2-(5-methylpyrazol-2-id-3-yl)-6-pyridin-2-yloxypyridine (CID 140729239) is chloropalladium(1+);2-(5-methylpyrazol-2-id-3-yl)-6-pyridin-2-yloxypyridine.
What is the SMILES notation for chloropalladium(1+);2-(5-methylpyrazol-2-id-3-yl)-6-pyridin-2-yloxypyridine?
The canonical SMILES for chloropalladium(1+);2-(5-methylpyrazol-2-id-3-yl)-6-pyridin-2-yloxypyridine is Cc1cc(-c2cccc(Oc3ccccn3)n2)[n-]n1.Cl[Pd+].
What is the InChIKey of chloropalladium(1+);2-(5-methylpyrazol-2-id-3-yl)-6-pyridin-2-yloxypyridine?
The InChIKey is BLODRFASDADUGV-UHFFFAOYSA-M. The full InChI is InChI=1S/C14H11N4O.ClH.Pd/c1-10-9-12(18-17-10)11-5-4-7-14(16-11)19-13-6-2-3-8-15-13;;/h2-9H,1H3;1H;/q-1;;+2/p-1.
What are the key properties of chloropalladium(1+);2-(5-methylpyrazol-2-id-3-yl)-6-pyridin-2-yloxypyridine?
chloropalladium(1+);2-(5-methylpyrazol-2-id-3-yl)-6-pyridin-2-yloxypyridine has a molecular weight of 393.14 g/mol, XLogP of 3.28, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for chloropalladium(1+);2-(5-methylpyrazol-2-id-3-yl)-6-pyridin-2-yloxypyridine is sourced from PubChem (CID 140729239), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).