3-propan-2-yl-4H-pyridazin-4-ide;yttrium

C7H9N2Y- — CID 58365330

IUPAC3-propan-2-yl-4H-pyridazin-4-ide;yttrium
SMILESCC(C)c1[c-]ccnn1.[Y]
InChIInChI=1S/C7H9N2.Y/c1-6(2)7-4-3-5-8-9-7;/h3,5-6H,1-2H3;/q-1;
InChIKeyZNHKFXIRWQRABC-UHFFFAOYSA-N
MW210.07 g/mol
LogP1.40
Rot. Bonds1

About 3-propan-2-yl-4H-pyridazin-4-ide;yttrium

3-propan-2-yl-4H-pyridazin-4-ide;yttrium (PubChem CID 58365330) has the molecular formula C7H9N2Y- and a molecular weight of 210.07 g/mol. Its IUPAC name is 3-propan-2-yl-4H-pyridazin-4-ide;yttrium.

Molecular Properties

Compound Name3-propan-2-yl-4H-pyridazin-4-ide;yttrium
PubChem CID58365330
Molecular FormulaC7H9N2Y-
Molecular Weight210.07 g/mol
Exact Mass209.98
IUPAC Name3-propan-2-yl-4H-pyridazin-4-ide;yttrium
SMILESCC(C)c1[c-]ccnn1.[Y]
InChIInChI=1S/C7H9N2.Y/c1-6(2)7-4-3-5-8-9-7;/h3,5-6H,1-2H3;/q-1;
InChIKeyZNHKFXIRWQRABC-UHFFFAOYSA-N
XLogP1.40
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.07
LogP ≤ 51.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

3-ethyl-4H-pyridazin-4-ide;vanadium
CID 60030447
(3E,4Z)-3,4-di(ethylidene)pyridazine
CID 88861141
3-Ethylidene-4-(2-methylbut-2-enylidene)pyridazine
CID 90967966
(3E,4Z)-4-(2-methylprop-2-enylidene)-3-propylidenepyridazine
CID 117904072
3-Prop-2-enylidene-4-propylidenepyridazine
CID 123259661
ethenyl-[(3Z)-2-methylhexa-3,5-dien-3-yl]diazene
CID 130369687
methyl-[(1Z,3E)-5-methylhexa-1,3-dienyl]diazene
CID 132243200
(3E,4Z)-3-ethylidene-4-[(E)-4-methylpent-2-enylidene]pyridazine
CID 139385892
(3E,4Z)-4-[(Z)-but-2-enylidene]-3-(2-methylpropylidene)pyridazine;ethane
CID 143599678
ethane;(3E)-4-methylidene-3-prop-2-enylidenepyridazine
CID 144316376
ethenyl-[(3Z,5E)-2-methylhepta-3,5-dien-3-yl]diazene
CID 155264477
(3E,4Z)-3-ethylidene-4-prop-2-enylidenepyridazine
CID 166817928

Frequently Asked Questions

What is the IUPAC name of 3-propan-2-yl-4H-pyridazin-4-ide;yttrium?
The IUPAC name of 3-propan-2-yl-4H-pyridazin-4-ide;yttrium (CID 58365330) is 3-propan-2-yl-4H-pyridazin-4-ide;yttrium.
What is the SMILES notation for 3-propan-2-yl-4H-pyridazin-4-ide;yttrium?
The canonical SMILES for 3-propan-2-yl-4H-pyridazin-4-ide;yttrium is CC(C)c1[c-]ccnn1.[Y].
What is the InChIKey of 3-propan-2-yl-4H-pyridazin-4-ide;yttrium?
The InChIKey is ZNHKFXIRWQRABC-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9N2.Y/c1-6(2)7-4-3-5-8-9-7;/h3,5-6H,1-2H3;/q-1;.
What are the key properties of 3-propan-2-yl-4H-pyridazin-4-ide;yttrium?
3-propan-2-yl-4H-pyridazin-4-ide;yttrium has a molecular weight of 210.07 g/mol, XLogP of 1.40, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-propan-2-yl-4H-pyridazin-4-ide;yttrium is sourced from PubChem (CID 58365330), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).