carbanide;3,4,5-trimethylpyrazol-1-ide;yttrium

C7H12N2Y-2 — CID 58651164

IUPACcarbanide;3,4,5-trimethylpyrazol-1-ide;yttrium
SMILESCc1n[n-]c(C)c1C.[CH3-].[Y]
InChIInChI=1S/C6H9N2.CH3.Y/c1-4-5(2)7-8-6(4)3;;/h1-3H3;1H3;/q2*-1;
InChIKeyCWIAOHOYUBMEQJ-UHFFFAOYSA-N
MW213.09 g/mol
LogP1.41
Rot. Bonds

About carbanide;3,4,5-trimethylpyrazol-1-ide;yttrium

carbanide;3,4,5-trimethylpyrazol-1-ide;yttrium (PubChem CID 58651164) has the molecular formula C7H12N2Y-2 and a molecular weight of 213.09 g/mol. Its IUPAC name is carbanide;3,4,5-trimethylpyrazol-1-ide;yttrium.

Molecular Properties

Compound Namecarbanide;3,4,5-trimethylpyrazol-1-ide;yttrium
PubChem CID58651164
Molecular FormulaC7H12N2Y-2
Molecular Weight213.09 g/mol
Exact Mass213.01
IUPAC Namecarbanide;3,4,5-trimethylpyrazol-1-ide;yttrium
SMILESCc1n[n-]c(C)c1C.[CH3-].[Y]
InChIInChI=1S/C6H9N2.CH3.Y/c1-4-5(2)7-8-6(4)3;;/h1-3H3;1H3;/q2*-1;
InChIKeyCWIAOHOYUBMEQJ-UHFFFAOYSA-N
XLogP1.41
TPSA26.99 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.09
LogP ≤ 51.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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 carbanide;3,4,5-trimethylpyrazol-1-ide;yttrium?
The IUPAC name of carbanide;3,4,5-trimethylpyrazol-1-ide;yttrium (CID 58651164) is carbanide;3,4,5-trimethylpyrazol-1-ide;yttrium.
What is the SMILES notation for carbanide;3,4,5-trimethylpyrazol-1-ide;yttrium?
The canonical SMILES for carbanide;3,4,5-trimethylpyrazol-1-ide;yttrium is Cc1n[n-]c(C)c1C.[CH3-].[Y].
What is the InChIKey of carbanide;3,4,5-trimethylpyrazol-1-ide;yttrium?
The InChIKey is CWIAOHOYUBMEQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9N2.CH3.Y/c1-4-5(2)7-8-6(4)3;;/h1-3H3;1H3;/q2*-1;.
What are the key properties of carbanide;3,4,5-trimethylpyrazol-1-ide;yttrium?
carbanide;3,4,5-trimethylpyrazol-1-ide;yttrium has a molecular weight of 213.09 g/mol, XLogP of 1.41, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for carbanide;3,4,5-trimethylpyrazol-1-ide;yttrium is sourced from PubChem (CID 58651164), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).