2-methyl-5-(trifluoromethyl)-3H-pyridin-3-ide;uranium(2+)

C7H5F3NU+ — CID 22982931

IUPAC2-methyl-5-(trifluoromethyl)-3H-pyridin-3-ide;uranium(2+)
SMILESCc1[c-]cc(C(F)(F)F)cn1.[U+2]
InChIInChI=1S/C7H5F3N.U/c1-5-2-3-6(4-11-5)7(8,9)10;/h3-4H,1H3;/q-1;+2
InChIKeyOTZMMSQWCRZMEB-UHFFFAOYSA-N
MW398.15 g/mol
LogP2.21
Rot. Bonds

About 2-methyl-5-(trifluoromethyl)-3H-pyridin-3-ide;uranium(2+)

2-methyl-5-(trifluoromethyl)-3H-pyridin-3-ide;uranium(2+) (PubChem CID 22982931) has the molecular formula C7H5F3NU+ and a molecular weight of 398.15 g/mol. Its IUPAC name is 2-methyl-5-(trifluoromethyl)-3H-pyridin-3-ide;uranium(2+).

Molecular Properties

Compound Name2-methyl-5-(trifluoromethyl)-3H-pyridin-3-ide;uranium(2+)
PubChem CID22982931
Molecular FormulaC7H5F3NU+
Molecular Weight398.15 g/mol
Exact Mass398.09
IUPAC Name2-methyl-5-(trifluoromethyl)-3H-pyridin-3-ide;uranium(2+)
SMILESCc1[c-]cc(C(F)(F)F)cn1.[U+2]
InChIInChI=1S/C7H5F3N.U/c1-5-2-3-6(4-11-5)7(8,9)10;/h3-4H,1H3;/q-1;+2
InChIKeyOTZMMSQWCRZMEB-UHFFFAOYSA-N
XLogP2.21
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms12
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500398.15
LogP ≤ 52.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-5-(trifluoromethyl)-3H-pyridin-3-ide;uranium(2+)?
The IUPAC name of 2-methyl-5-(trifluoromethyl)-3H-pyridin-3-ide;uranium(2+) (CID 22982931) is 2-methyl-5-(trifluoromethyl)-3H-pyridin-3-ide;uranium(2+).
What is the SMILES notation for 2-methyl-5-(trifluoromethyl)-3H-pyridin-3-ide;uranium(2+)?
The canonical SMILES for 2-methyl-5-(trifluoromethyl)-3H-pyridin-3-ide;uranium(2+) is Cc1[c-]cc(C(F)(F)F)cn1.[U+2].
What is the InChIKey of 2-methyl-5-(trifluoromethyl)-3H-pyridin-3-ide;uranium(2+)?
The InChIKey is OTZMMSQWCRZMEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H5F3N.U/c1-5-2-3-6(4-11-5)7(8,9)10;/h3-4H,1H3;/q-1;+2.
What are the key properties of 2-methyl-5-(trifluoromethyl)-3H-pyridin-3-ide;uranium(2+)?
2-methyl-5-(trifluoromethyl)-3H-pyridin-3-ide;uranium(2+) has a molecular weight of 398.15 g/mol, XLogP of 2.21, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-5-(trifluoromethyl)-3H-pyridin-3-ide;uranium(2+) is sourced from PubChem (CID 22982931), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).