zinc;carbanide;2-(5-methylpyrazol-2-id-3-yl)pyridine

C10H11N3Zn — CID 156628337

IUPACzinc;carbanide;2-(5-methylpyrazol-2-id-3-yl)pyridine
SMILESCc1cc(-c2ccccn2)[n-]n1.[CH3-].[Zn+2]
InChIInChI=1S/C9H8N3.CH3.Zn/c1-7-6-9(12-11-7)8-4-2-3-5-10-8;;/h2-6H,1H3;1H3;/q2*-1;+2
InChIKeySHRVHIFNSCCHIB-UHFFFAOYSA-N
MW238.61 g/mol
LogP1.86
Rot. Bonds1

About zinc;carbanide;2-(5-methylpyrazol-2-id-3-yl)pyridine

zinc;carbanide;2-(5-methylpyrazol-2-id-3-yl)pyridine (PubChem CID 156628337) has the molecular formula C10H11N3Zn and a molecular weight of 238.61 g/mol. Its IUPAC name is zinc;carbanide;2-(5-methylpyrazol-2-id-3-yl)pyridine.

Molecular Properties

Compound Namezinc;carbanide;2-(5-methylpyrazol-2-id-3-yl)pyridine
PubChem CID156628337
Molecular FormulaC10H11N3Zn
Molecular Weight238.61 g/mol
Exact Mass237.02
IUPAC Namezinc;carbanide;2-(5-methylpyrazol-2-id-3-yl)pyridine
SMILESCc1cc(-c2ccccn2)[n-]n1.[CH3-].[Zn+2]
InChIInChI=1S/C9H8N3.CH3.Zn/c1-7-6-9(12-11-7)8-4-2-3-5-10-8;;/h2-6H,1H3;1H3;/q2*-1;+2
InChIKeySHRVHIFNSCCHIB-UHFFFAOYSA-N
XLogP1.86
TPSA39.88 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.61
LogP ≤ 51.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-(5-methylpyrazol-2-id-3-yl)pyridine
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iridium;2-(5-methylpyrazol-2-id-3-yl)pyridine
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2-(5-methylpyrazol-2-id-3-yl)pyridine;platinum;bis(yttrium)
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2-(5-methylpyrazol-2-id-3-yl)pyridine;pyridine-2-carboxylic acid;zinc
CID 58858981
3-methyl-5-phenylpyrazol-1-ide;2-(4-methylpyrrol-1-id-2-yl)pyridine;platinum
CID 171055621
iridium(3+);2-(5-methylpyrazol-2-id-3-yl)-6-[3-[[6-(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy-2-pyridinyl]oxy]benzene-2-id-1-yl]oxypyridine
CID 140597831
bis(2-(5-methyl-1,4-diaza-2-azanidacyclopenta-3,5-dien-3-yl)pyridine);bis(2-(5-methylpyrazol-2-id-3-yl)pyrazine);tris(2-(5-methylpyrazol-2-id-3-yl)pyridine);tetrakis(platinum(2+));2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine
CID 158317289
2-(3-tert-butylpyrazol-1-id-5-yl)pyridine;4-(3-tert-butylpyrazol-1-id-5-yl)pyrimidine;platinum(2+)
CID 140723069
bis(2,6-dipyridin-2-ylpyridine);2-(3-pyridin-2-ylpyrazol-1-id-5-yl)pyridine;bis(ruthenium(2+));trihexafluorophosphate;dihydrate
CID 11251912

Frequently Asked Questions

What is the IUPAC name of zinc;carbanide;2-(5-methylpyrazol-2-id-3-yl)pyridine?
The IUPAC name of zinc;carbanide;2-(5-methylpyrazol-2-id-3-yl)pyridine (CID 156628337) is zinc;carbanide;2-(5-methylpyrazol-2-id-3-yl)pyridine.
What is the SMILES notation for zinc;carbanide;2-(5-methylpyrazol-2-id-3-yl)pyridine?
The canonical SMILES for zinc;carbanide;2-(5-methylpyrazol-2-id-3-yl)pyridine is Cc1cc(-c2ccccn2)[n-]n1.[CH3-].[Zn+2].
What is the InChIKey of zinc;carbanide;2-(5-methylpyrazol-2-id-3-yl)pyridine?
The InChIKey is SHRVHIFNSCCHIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8N3.CH3.Zn/c1-7-6-9(12-11-7)8-4-2-3-5-10-8;;/h2-6H,1H3;1H3;/q2*-1;+2.
What are the key properties of zinc;carbanide;2-(5-methylpyrazol-2-id-3-yl)pyridine?
zinc;carbanide;2-(5-methylpyrazol-2-id-3-yl)pyridine has a molecular weight of 238.61 g/mol, XLogP of 1.86, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for zinc;carbanide;2-(5-methylpyrazol-2-id-3-yl)pyridine is sourced from PubChem (CID 156628337), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).