1-(1,2,3,4,5-pentamethylpyrrolidin-4-id-2-yl)ethanone;yttrium

C11H20NOY- — CID 59247985

IUPAC1-(1,2,3,4,5-pentamethylpyrrolidin-4-id-2-yl)ethanone;yttrium
SMILESCC(=O)C1(C)C(C)[C-](C)C(C)N1C.[Y]
InChIInChI=1S/C11H20NO.Y/c1-7-8(2)11(5,10(4)13)12(6)9(7)3;/h8-9H,1-6H3;/q-1;
InChIKeyXJTJEQFWRMIQRJ-UHFFFAOYSA-N
MW271.19 g/mol
LogP1.90
Rot. Bonds1

About 1-(1,2,3,4,5-pentamethylpyrrolidin-4-id-2-yl)ethanone;yttrium

1-(1,2,3,4,5-pentamethylpyrrolidin-4-id-2-yl)ethanone;yttrium (PubChem CID 59247985) has the molecular formula C11H20NOY- and a molecular weight of 271.19 g/mol. Its IUPAC name is 1-(1,2,3,4,5-pentamethylpyrrolidin-4-id-2-yl)ethanone;yttrium.

Molecular Properties

Compound Name1-(1,2,3,4,5-pentamethylpyrrolidin-4-id-2-yl)ethanone;yttrium
PubChem CID59247985
Molecular FormulaC11H20NOY-
Molecular Weight271.19 g/mol
Exact Mass271.06
IUPAC Name1-(1,2,3,4,5-pentamethylpyrrolidin-4-id-2-yl)ethanone;yttrium
SMILESCC(=O)C1(C)C(C)[C-](C)C(C)N1C.[Y]
InChIInChI=1S/C11H20NO.Y/c1-7-8(2)11(5,10(4)13)12(6)9(7)3;/h8-9H,1-6H3;/q-1;
InChIKeyXJTJEQFWRMIQRJ-UHFFFAOYSA-N
XLogP1.90
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.19
LogP ≤ 51.90
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

1-(1,2-dimethylazetidin-2-yl)ethanone
CID 130343037
1-[(3S,4R)-1,3,4-trimethylpyrrolidin-3-yl]ethanone
CID 130186895
(3S)-1,2,2,3-tetramethylaziridine
CID 153012898
1-[(3S,5S)-4-hydroxy-1,3,5-trimethylpiperidin-4-yl]ethanone
CID 763057
1-[(4S)-3,3,4-trimethylpyrrolidin-1-yl]ethanone
CID 174295698
1-[(2S,3R)-1,3-dimethylaziridin-2-yl]ethanone
CID 45085035
1-(1,5,5-trimethylpyrrolidin-2-yl)propan-2-one
CID 130027677
(3R,4R,5S)-3-acetyl-3,4,5-trimethyloxolan-2-one
CID 102445769
1-(1-azabicyclo[2.2.1]heptan-4-yl)ethanone
CID 10678310
1-[2-(dimethylamino)-1,3,4-trimethyl-2H-pyrimidin-4-yl]ethanone
CID 87459557
1-(4-acetyl-1-bicyclo[2.2.2]octanyl)ethanone
CID 13227637
1-(3-acetyl-1-bicyclo[1.1.1]pentanyl)ethanone
CID 11159413

Frequently Asked Questions

What is the IUPAC name of 1-(1,2,3,4,5-pentamethylpyrrolidin-4-id-2-yl)ethanone;yttrium?
The IUPAC name of 1-(1,2,3,4,5-pentamethylpyrrolidin-4-id-2-yl)ethanone;yttrium (CID 59247985) is 1-(1,2,3,4,5-pentamethylpyrrolidin-4-id-2-yl)ethanone;yttrium.
What is the SMILES notation for 1-(1,2,3,4,5-pentamethylpyrrolidin-4-id-2-yl)ethanone;yttrium?
The canonical SMILES for 1-(1,2,3,4,5-pentamethylpyrrolidin-4-id-2-yl)ethanone;yttrium is CC(=O)C1(C)C(C)[C-](C)C(C)N1C.[Y].
What is the InChIKey of 1-(1,2,3,4,5-pentamethylpyrrolidin-4-id-2-yl)ethanone;yttrium?
The InChIKey is XJTJEQFWRMIQRJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20NO.Y/c1-7-8(2)11(5,10(4)13)12(6)9(7)3;/h8-9H,1-6H3;/q-1;.
What are the key properties of 1-(1,2,3,4,5-pentamethylpyrrolidin-4-id-2-yl)ethanone;yttrium?
1-(1,2,3,4,5-pentamethylpyrrolidin-4-id-2-yl)ethanone;yttrium has a molecular weight of 271.19 g/mol, XLogP of 1.90, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1,2,3,4,5-pentamethylpyrrolidin-4-id-2-yl)ethanone;yttrium is sourced from PubChem (CID 59247985), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).