carbanide;1-ethyl-3-methanidyl-1,3-diazetidine;yttrium

C6H14N2Y-2 — CID 59967719

IUPACcarbanide;1-ethyl-3-methanidyl-1,3-diazetidine;yttrium
SMILES[CH2-]N1CN(CC)C1.[CH3-].[Y]
InChIInChI=1S/C5H11N2.CH3.Y/c1-3-7-4-6(2)5-7;;/h2-5H2,1H3;1H3;/q2*-1;
InChIKeyJKPVSWGDRKRSIZ-UHFFFAOYSA-N
MW203.10 g/mol
LogP0.78
Rot. Bonds1

About carbanide;1-ethyl-3-methanidyl-1,3-diazetidine;yttrium

carbanide;1-ethyl-3-methanidyl-1,3-diazetidine;yttrium (PubChem CID 59967719) has the molecular formula C6H14N2Y-2 and a molecular weight of 203.10 g/mol. Its IUPAC name is carbanide;1-ethyl-3-methanidyl-1,3-diazetidine;yttrium.

Molecular Properties

Compound Namecarbanide;1-ethyl-3-methanidyl-1,3-diazetidine;yttrium
PubChem CID59967719
Molecular FormulaC6H14N2Y-2
Molecular Weight203.10 g/mol
Exact Mass203.02
IUPAC Namecarbanide;1-ethyl-3-methanidyl-1,3-diazetidine;yttrium
SMILES[CH2-]N1CN(CC)C1.[CH3-].[Y]
InChIInChI=1S/C5H11N2.CH3.Y/c1-3-7-4-6(2)5-7;;/h2-5H2,1H3;1H3;/q2*-1;
InChIKeyJKPVSWGDRKRSIZ-UHFFFAOYSA-N
XLogP0.78
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.10
LogP ≤ 50.78
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

hydron;1,3,5-triethyl-1,3,5-triazinane
CID 174488604
1-tert-butyl-3-ethyl-1,3-diazetidine
CID 167026910
1,4,7,10,13,16-hexaethyl-1,4,7,10,13,16-hexazacyclooctadecane
CID 66730221
1,4-diethylpiperazine;sulfane
CID 177062456
1-ethyl-3,5-bis(isocyanomethyl)-1,3,5-triazinane
CID 58761110
1,6-diethyl-1,6-diazecane
CID 172611513
CID 58681854
CID 58681854
1-ethyl-3-iodoimidazolidine
CID 90298671
1-ethylpyrrolidine;hydrofluoride
CID 163271504
1-ethylpiperidine
CID 13007
4,10-diethyl-1,4,7,10-tetrazabicyclo[5.5.2]tetradecane
CID 18740677
disodium;2-[3-(carboxylatomethyl)-5-ethyl-1,3,5-triazinan-1-yl]acetate
CID 59693405

Frequently Asked Questions

What is the IUPAC name of carbanide;1-ethyl-3-methanidyl-1,3-diazetidine;yttrium?
The IUPAC name of carbanide;1-ethyl-3-methanidyl-1,3-diazetidine;yttrium (CID 59967719) is carbanide;1-ethyl-3-methanidyl-1,3-diazetidine;yttrium.
What is the SMILES notation for carbanide;1-ethyl-3-methanidyl-1,3-diazetidine;yttrium?
The canonical SMILES for carbanide;1-ethyl-3-methanidyl-1,3-diazetidine;yttrium is [CH2-]N1CN(CC)C1.[CH3-].[Y].
What is the InChIKey of carbanide;1-ethyl-3-methanidyl-1,3-diazetidine;yttrium?
The InChIKey is JKPVSWGDRKRSIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H11N2.CH3.Y/c1-3-7-4-6(2)5-7;;/h2-5H2,1H3;1H3;/q2*-1;.
What are the key properties of carbanide;1-ethyl-3-methanidyl-1,3-diazetidine;yttrium?
carbanide;1-ethyl-3-methanidyl-1,3-diazetidine;yttrium has a molecular weight of 203.10 g/mol, XLogP of 0.78, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for carbanide;1-ethyl-3-methanidyl-1,3-diazetidine;yttrium is sourced from PubChem (CID 59967719), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).