carbanide;5-ethyl-7,7-di(ethyl)-5,6-dihydrocyclopenta[c]pyridine;yttrium(3+)

C15H22NY — CID 59590991

IUPACcarbanide;5-ethyl-7,7-di(ethyl)-5,6-dihydrocyclopenta[c]pyridine;yttrium(3+)
SMILES[CH2-]CC1(C[CH2-])CC(CC)c2ccncc21.[CH3-].[Y+3]
InChIInChI=1S/C14H19N.CH3.Y/c1-4-11-9-14(5-2,6-3)13-10-15-8-7-12(11)13;;/h7-8,10-11H,2-6,9H2,1H3;1H3;/q-2;-1;+3
InChIKeyMWHDAOSYTOXGQJ-UHFFFAOYSA-N
MW305.25 g/mol
LogP4.11
Rot. Bonds3

About carbanide;5-ethyl-7,7-di(ethyl)-5,6-dihydrocyclopenta[c]pyridine;yttrium(3+)

carbanide;5-ethyl-7,7-di(ethyl)-5,6-dihydrocyclopenta[c]pyridine;yttrium(3+) (PubChem CID 59590991) has the molecular formula C15H22NY and a molecular weight of 305.25 g/mol. Its IUPAC name is carbanide;5-ethyl-7,7-di(ethyl)-5,6-dihydrocyclopenta[c]pyridine;yttrium(3+).

Molecular Properties

Compound Namecarbanide;5-ethyl-7,7-di(ethyl)-5,6-dihydrocyclopenta[c]pyridine;yttrium(3+)
PubChem CID59590991
Molecular FormulaC15H22NY
Molecular Weight305.25 g/mol
Exact Mass305.08
IUPAC Namecarbanide;5-ethyl-7,7-di(ethyl)-5,6-dihydrocyclopenta[c]pyridine;yttrium(3+)
SMILES[CH2-]CC1(C[CH2-])CC(CC)c2ccncc21.[CH3-].[Y+3]
InChIInChI=1S/C14H19N.CH3.Y/c1-4-11-9-14(5-2,6-3)13-10-15-8-7-12(11)13;;/h7-8,10-11H,2-6,9H2,1H3;1H3;/q-2;-1;+3
InChIKeyMWHDAOSYTOXGQJ-UHFFFAOYSA-N
XLogP4.11
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.25
LogP ≤ 54.11
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;5-ethyl-7,7-di(ethyl)-5,6-dihydrocyclopenta[c]pyridine;yttrium(3+)?
The IUPAC name of carbanide;5-ethyl-7,7-di(ethyl)-5,6-dihydrocyclopenta[c]pyridine;yttrium(3+) (CID 59590991) is carbanide;5-ethyl-7,7-di(ethyl)-5,6-dihydrocyclopenta[c]pyridine;yttrium(3+).
What is the SMILES notation for carbanide;5-ethyl-7,7-di(ethyl)-5,6-dihydrocyclopenta[c]pyridine;yttrium(3+)?
The canonical SMILES for carbanide;5-ethyl-7,7-di(ethyl)-5,6-dihydrocyclopenta[c]pyridine;yttrium(3+) is [CH2-]CC1(C[CH2-])CC(CC)c2ccncc21.[CH3-].[Y+3].
What is the InChIKey of carbanide;5-ethyl-7,7-di(ethyl)-5,6-dihydrocyclopenta[c]pyridine;yttrium(3+)?
The InChIKey is MWHDAOSYTOXGQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N.CH3.Y/c1-4-11-9-14(5-2,6-3)13-10-15-8-7-12(11)13;;/h7-8,10-11H,2-6,9H2,1H3;1H3;/q-2;-1;+3.
What are the key properties of carbanide;5-ethyl-7,7-di(ethyl)-5,6-dihydrocyclopenta[c]pyridine;yttrium(3+)?
carbanide;5-ethyl-7,7-di(ethyl)-5,6-dihydrocyclopenta[c]pyridine;yttrium(3+) has a molecular weight of 305.25 g/mol, XLogP of 4.11, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for carbanide;5-ethyl-7,7-di(ethyl)-5,6-dihydrocyclopenta[c]pyridine;yttrium(3+) is sourced from PubChem (CID 59590991), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).