actinium;2-methylpyrazolidin-1-id-3-one

C4H7AcN2O- — CID 59977834

IUPACactinium;2-methylpyrazolidin-1-id-3-one
SMILESCN1[N-]CCC1=O.[Ac]
InChIInChI=1S/C4H7N2O.Ac/c1-6-4(7)2-3-5-6;/h2-3H2,1H3;/q-1;
InChIKeyJLFCJGKXXCUSFS-UHFFFAOYSA-N
MW326.11 g/mol
LogP0.14
Rot. Bonds

About actinium;2-methylpyrazolidin-1-id-3-one

actinium;2-methylpyrazolidin-1-id-3-one (PubChem CID 59977834) has the molecular formula C4H7AcN2O- and a molecular weight of 326.11 g/mol. Its IUPAC name is actinium;2-methylpyrazolidin-1-id-3-one.

Molecular Properties

Compound Nameactinium;2-methylpyrazolidin-1-id-3-one
PubChem CID59977834
Molecular FormulaC4H7AcN2O-
Molecular Weight326.11 g/mol
Exact Mass326.08
IUPAC Nameactinium;2-methylpyrazolidin-1-id-3-one
SMILESCN1[N-]CCC1=O.[Ac]
InChIInChI=1S/C4H7N2O.Ac/c1-6-4(7)2-3-5-6;/h2-3H2,1H3;/q-1;
InChIKeyJLFCJGKXXCUSFS-UHFFFAOYSA-N
XLogP0.14
TPSA34.41 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.11
LogP ≤ 50.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of actinium;2-methylpyrazolidin-1-id-3-one?
The IUPAC name of actinium;2-methylpyrazolidin-1-id-3-one (CID 59977834) is actinium;2-methylpyrazolidin-1-id-3-one.
What is the SMILES notation for actinium;2-methylpyrazolidin-1-id-3-one?
The canonical SMILES for actinium;2-methylpyrazolidin-1-id-3-one is CN1[N-]CCC1=O.[Ac].
What is the InChIKey of actinium;2-methylpyrazolidin-1-id-3-one?
The InChIKey is JLFCJGKXXCUSFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H7N2O.Ac/c1-6-4(7)2-3-5-6;/h2-3H2,1H3;/q-1;.
What are the key properties of actinium;2-methylpyrazolidin-1-id-3-one?
actinium;2-methylpyrazolidin-1-id-3-one has a molecular weight of 326.11 g/mol, XLogP of 0.14, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for actinium;2-methylpyrazolidin-1-id-3-one is sourced from PubChem (CID 59977834), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).