2,3-dimethyl-4,5-dihydrocyclopenta[b]pyridin-4-ide;yttrium

C10H10NY- — CID 59059997

IUPAC2,3-dimethyl-4,5-dihydrocyclopenta[b]pyridin-4-ide;yttrium
SMILESCc1[c-]c2c(nc1C)C=CC2.[Y]
InChIInChI=1S/C10H10N.Y/c1-7-6-9-4-3-5-10(9)11-8(7)2;/h3,5H,4H2,1-2H3;/q-1;
InChIKeyNSIYZBFGQQMKBU-UHFFFAOYSA-N
MW233.10 g/mol
LogP2.07
Rot. Bonds

About 2,3-dimethyl-4,5-dihydrocyclopenta[b]pyridin-4-ide;yttrium

2,3-dimethyl-4,5-dihydrocyclopenta[b]pyridin-4-ide;yttrium (PubChem CID 59059997) has the molecular formula C10H10NY- and a molecular weight of 233.10 g/mol. Its IUPAC name is 2,3-dimethyl-4,5-dihydrocyclopenta[b]pyridin-4-ide;yttrium.

Molecular Properties

Compound Name2,3-dimethyl-4,5-dihydrocyclopenta[b]pyridin-4-ide;yttrium
PubChem CID59059997
Molecular FormulaC10H10NY-
Molecular Weight233.10 g/mol
Exact Mass232.99
IUPAC Name2,3-dimethyl-4,5-dihydrocyclopenta[b]pyridin-4-ide;yttrium
SMILESCc1[c-]c2c(nc1C)C=CC2.[Y]
InChIInChI=1S/C10H10N.Y/c1-7-6-9-4-3-5-10(9)11-8(7)2;/h3,5H,4H2,1-2H3;/q-1;
InChIKeyNSIYZBFGQQMKBU-UHFFFAOYSA-N
XLogP2.07
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms12
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.10
LogP ≤ 52.07
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 2,3-dimethyl-4,5-dihydrocyclopenta[b]pyridin-4-ide;yttrium?
The IUPAC name of 2,3-dimethyl-4,5-dihydrocyclopenta[b]pyridin-4-ide;yttrium (CID 59059997) is 2,3-dimethyl-4,5-dihydrocyclopenta[b]pyridin-4-ide;yttrium.
What is the SMILES notation for 2,3-dimethyl-4,5-dihydrocyclopenta[b]pyridin-4-ide;yttrium?
The canonical SMILES for 2,3-dimethyl-4,5-dihydrocyclopenta[b]pyridin-4-ide;yttrium is Cc1[c-]c2c(nc1C)C=CC2.[Y].
What is the InChIKey of 2,3-dimethyl-4,5-dihydrocyclopenta[b]pyridin-4-ide;yttrium?
The InChIKey is NSIYZBFGQQMKBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N.Y/c1-7-6-9-4-3-5-10(9)11-8(7)2;/h3,5H,4H2,1-2H3;/q-1;.
What are the key properties of 2,3-dimethyl-4,5-dihydrocyclopenta[b]pyridin-4-ide;yttrium?
2,3-dimethyl-4,5-dihydrocyclopenta[b]pyridin-4-ide;yttrium has a molecular weight of 233.10 g/mol, XLogP of 2.07, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dimethyl-4,5-dihydrocyclopenta[b]pyridin-4-ide;yttrium is sourced from PubChem (CID 59059997), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).