3-methanidyl-1-methylpyrrolidin-2-ide;yttrium

C6H11NY-2 — CID 58095395

IUPAC3-methanidyl-1-methylpyrrolidin-2-ide;yttrium
SMILES[CH2-]C1[CH-]N(C)CC1.[Y]
InChIInChI=1S/C6H11N.Y/c1-6-3-4-7(2)5-6;/h5-6H,1,3-4H2,2H3;/q-2;
InChIKeyVCGSXUIDJHFIFR-UHFFFAOYSA-N
MW186.07 g/mol
LogP0.93
Rot. Bonds

About 3-methanidyl-1-methylpyrrolidin-2-ide;yttrium

3-methanidyl-1-methylpyrrolidin-2-ide;yttrium (PubChem CID 58095395) has the molecular formula C6H11NY-2 and a molecular weight of 186.07 g/mol. Its IUPAC name is 3-methanidyl-1-methylpyrrolidin-2-ide;yttrium.

Molecular Properties

Compound Name3-methanidyl-1-methylpyrrolidin-2-ide;yttrium
PubChem CID58095395
Molecular FormulaC6H11NY-2
Molecular Weight186.07 g/mol
Exact Mass186.00
IUPAC Name3-methanidyl-1-methylpyrrolidin-2-ide;yttrium
SMILES[CH2-]C1[CH-]N(C)CC1.[Y]
InChIInChI=1S/C6H11N.Y/c1-6-3-4-7(2)5-6;/h5-6H,1,3-4H2,2H3;/q-2;
InChIKeyVCGSXUIDJHFIFR-UHFFFAOYSA-N
XLogP0.93
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.07
LogP ≤ 50.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze 3-methanidyl-1-methylpyrrolidin-2-ide;yttrium with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-methanidyl-1-methylpiperidine;uranium
CID 58931509
methane;1-methyl-4-(1-methylpiperidin-4-yl)piperidine
CID 158947160
(2R)-2-methanidyl-1-methylpyrrolidine;tungsten
CID 178106473
3-ethyl-4-methanidyl-1-methylpiperidine;yttrium
CID 58095413
4-ethyl-1-methylpiperidin-5-ide;yttrium
CID 58095449
6,7-dimethoxy-1-(1-methylpiperidin-4-yl)-1,2,3,4-tetrahydroisoquinoline
CID 112511947
2-(1-methylpyrrolidin-2-yl)pyrimidine
CID 89060530
lithium (3aR,7aR)-2-methyl-1,3,3a,4,5,6,7,7a-octahydroisoindol-1-ide
CID 16689765
1-cyclopropyl-6,7-dimethoxy-2-methyl-3,4-dihydro-1H-isoquinoline
CID 14939993
7-methyl-1,2,3,4,4a,5,6,7a-octahydropyrrolo[2,3-c]pyridazine
CID 145301468
(1S,6R)-3-methyl-3,8-diazabicyclo[4.2.0]octane
CID 71432744
5-methyl-5-azabicyclo[2.1.0]pentane
CID 102031260

Frequently Asked Questions

What is the IUPAC name of 3-methanidyl-1-methylpyrrolidin-2-ide;yttrium?
The IUPAC name of 3-methanidyl-1-methylpyrrolidin-2-ide;yttrium (CID 58095395) is 3-methanidyl-1-methylpyrrolidin-2-ide;yttrium.
What is the SMILES notation for 3-methanidyl-1-methylpyrrolidin-2-ide;yttrium?
The canonical SMILES for 3-methanidyl-1-methylpyrrolidin-2-ide;yttrium is [CH2-]C1[CH-]N(C)CC1.[Y].
What is the InChIKey of 3-methanidyl-1-methylpyrrolidin-2-ide;yttrium?
The InChIKey is VCGSXUIDJHFIFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11N.Y/c1-6-3-4-7(2)5-6;/h5-6H,1,3-4H2,2H3;/q-2;.
What are the key properties of 3-methanidyl-1-methylpyrrolidin-2-ide;yttrium?
3-methanidyl-1-methylpyrrolidin-2-ide;yttrium has a molecular weight of 186.07 g/mol, XLogP of 0.93, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methanidyl-1-methylpyrrolidin-2-ide;yttrium is sourced from PubChem (CID 58095395), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).