4-(3H-pyridin-3-id-4-yl)-3H-pyridin-3-ide;yttrium

C10H6N2Y-2 — CID 58813677

IUPAC4-(3H-pyridin-3-id-4-yl)-3H-pyridin-3-ide;yttrium
SMILES[Y].[c-]1cnccc1-c1[c-]cncc1
InChIInChI=1S/C10H6N2.Y/c1-5-11-6-2-9(1)10-3-7-12-8-4-10;/h1,3,5-8H;/q-2;
InChIKeyMNCQPBHCLAHKDS-UHFFFAOYSA-N
MW243.08 g/mol
LogP1.74
Rot. Bonds1

About 4-(3H-pyridin-3-id-4-yl)-3H-pyridin-3-ide;yttrium

4-(3H-pyridin-3-id-4-yl)-3H-pyridin-3-ide;yttrium (PubChem CID 58813677) has the molecular formula C10H6N2Y-2 and a molecular weight of 243.08 g/mol. Its IUPAC name is 4-(3H-pyridin-3-id-4-yl)-3H-pyridin-3-ide;yttrium.

Molecular Properties

Compound Name4-(3H-pyridin-3-id-4-yl)-3H-pyridin-3-ide;yttrium
PubChem CID58813677
Molecular FormulaC10H6N2Y-2
Molecular Weight243.08 g/mol
Exact Mass242.96
IUPAC Name4-(3H-pyridin-3-id-4-yl)-3H-pyridin-3-ide;yttrium
SMILES[Y].[c-]1cnccc1-c1[c-]cncc1
InChIInChI=1S/C10H6N2.Y/c1-5-11-6-2-9(1)10-3-7-12-8-4-10;/h1,3,5-8H;/q-2;
InChIKeyMNCQPBHCLAHKDS-UHFFFAOYSA-N
XLogP1.74
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.08
LogP ≤ 51.74
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

Cyclobuta[1,2-c:4,3-c']dipyridine
CID 141663
6H-Cyclopenta[C]pyridine
CID 56972380
4H-isoindole
CID 57015883
5H-isoindole
CID 57235079
2-(3H-pyridin-3-id-4-yl)-3H-pyridin-3-ide;yttrium
CID 58813429
2-(4H-pyridin-4-id-3-yl)-3H-pyridin-3-ide;yttrium
CID 58813475
3-(3H-pyridin-3-id-4-yl)-2H-pyridin-2-ide;yttrium
CID 58813492
3-(3H-pyridin-3-id-4-yl)-4H-pyridin-4-ide;yttrium
CID 58813527
3-(2H-pyridin-2-id-3-yl)-4H-pyridin-4-ide;yttrium
CID 58813586
3-(2H-pyridin-2-id-3-yl)-2H-pyridin-2-ide;yttrium
CID 58813801
3-phenyl-2H-pyridin-2-ide;yttrium
CID 58813895
3-(4H-pyridin-4-id-3-yl)-4H-pyridin-4-ide;yttrium
CID 58813967

Frequently Asked Questions

What is the IUPAC name of 4-(3H-pyridin-3-id-4-yl)-3H-pyridin-3-ide;yttrium?
The IUPAC name of 4-(3H-pyridin-3-id-4-yl)-3H-pyridin-3-ide;yttrium (CID 58813677) is 4-(3H-pyridin-3-id-4-yl)-3H-pyridin-3-ide;yttrium.
What is the SMILES notation for 4-(3H-pyridin-3-id-4-yl)-3H-pyridin-3-ide;yttrium?
The canonical SMILES for 4-(3H-pyridin-3-id-4-yl)-3H-pyridin-3-ide;yttrium is [Y].[c-]1cnccc1-c1[c-]cncc1.
What is the InChIKey of 4-(3H-pyridin-3-id-4-yl)-3H-pyridin-3-ide;yttrium?
The InChIKey is MNCQPBHCLAHKDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H6N2.Y/c1-5-11-6-2-9(1)10-3-7-12-8-4-10;/h1,3,5-8H;/q-2;.
What are the key properties of 4-(3H-pyridin-3-id-4-yl)-3H-pyridin-3-ide;yttrium?
4-(3H-pyridin-3-id-4-yl)-3H-pyridin-3-ide;yttrium has a molecular weight of 243.08 g/mol, XLogP of 1.74, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3H-pyridin-3-id-4-yl)-3H-pyridin-3-ide;yttrium is sourced from PubChem (CID 58813677), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).