[methyl(methylamino)amino]methanone;yttrium(3+)

C3H7N2OY+2 — CID 20669940

IUPAC[methyl(methylamino)amino]methanone;yttrium(3+)
SMILESCNN(C)[C-]=O.[Y+3]
InChIInChI=1S/C3H7N2O.Y/c1-4-5(2)3-6;/h4H,1-2H3;/q-1;+3
InChIKeyKRPHCBSGYZHFCA-UHFFFAOYSA-N
MW176.01 g/mol
LogP-0.88
Rot. Bonds2

About [methyl(methylamino)amino]methanone;yttrium(3+)

[methyl(methylamino)amino]methanone;yttrium(3+) (PubChem CID 20669940) has the molecular formula C3H7N2OY+2 and a molecular weight of 176.01 g/mol. Its IUPAC name is [methyl(methylamino)amino]methanone;yttrium(3+).

Molecular Properties

Compound Name[methyl(methylamino)amino]methanone;yttrium(3+)
PubChem CID20669940
Molecular FormulaC3H7N2OY+2
Molecular Weight176.01 g/mol
Exact Mass175.96
IUPAC Name[methyl(methylamino)amino]methanone;yttrium(3+)
SMILESCNN(C)[C-]=O.[Y+3]
InChIInChI=1S/C3H7N2O.Y/c1-4-5(2)3-6;/h4H,1-2H3;/q-1;+3
InChIKeyKRPHCBSGYZHFCA-UHFFFAOYSA-N
XLogP-0.88
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms7
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.01
LogP ≤ 5-0.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'enamine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of [methyl(methylamino)amino]methanone;yttrium(3+)?
The IUPAC name of [methyl(methylamino)amino]methanone;yttrium(3+) (CID 20669940) is [methyl(methylamino)amino]methanone;yttrium(3+).
What is the SMILES notation for [methyl(methylamino)amino]methanone;yttrium(3+)?
The canonical SMILES for [methyl(methylamino)amino]methanone;yttrium(3+) is CNN(C)[C-]=O.[Y+3].
What is the InChIKey of [methyl(methylamino)amino]methanone;yttrium(3+)?
The InChIKey is KRPHCBSGYZHFCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H7N2O.Y/c1-4-5(2)3-6;/h4H,1-2H3;/q-1;+3.
What are the key properties of [methyl(methylamino)amino]methanone;yttrium(3+)?
[methyl(methylamino)amino]methanone;yttrium(3+) has a molecular weight of 176.01 g/mol, XLogP of -0.88, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [methyl(methylamino)amino]methanone;yttrium(3+) is sourced from PubChem (CID 20669940), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).