3-methyl-5-propan-2-yl-2,4-dihydropyridine-2,4-diide;bis(rhodium)

C9H11NRh2-2 — CID 58126729

IUPAC3-methyl-5-propan-2-yl-2,4-dihydropyridine-2,4-diide;bis(rhodium)
SMILESCc1[c-]ncc(C(C)C)[c-]1.[Rh].[Rh]
InChIInChI=1S/C9H11N.2Rh/c1-7(2)9-4-8(3)5-10-6-9;;/h6-7H,1-3H3;;/q-2;;
InChIKeyLMXYEKJNGNOHOG-UHFFFAOYSA-N
MW339.01 g/mol
LogP2.11
Rot. Bonds1

About 3-methyl-5-propan-2-yl-2,4-dihydropyridine-2,4-diide;bis(rhodium)

3-methyl-5-propan-2-yl-2,4-dihydropyridine-2,4-diide;bis(rhodium) (PubChem CID 58126729) has the molecular formula C9H11NRh2-2 and a molecular weight of 339.01 g/mol. Its IUPAC name is 3-methyl-5-propan-2-yl-2,4-dihydropyridine-2,4-diide;bis(rhodium).

Molecular Properties

Compound Name3-methyl-5-propan-2-yl-2,4-dihydropyridine-2,4-diide;bis(rhodium)
PubChem CID58126729
Molecular FormulaC9H11NRh2-2
Molecular Weight339.01 g/mol
Exact Mass338.90
IUPAC Name3-methyl-5-propan-2-yl-2,4-dihydropyridine-2,4-diide;bis(rhodium)
SMILESCc1[c-]ncc(C(C)C)[c-]1.[Rh].[Rh]
InChIInChI=1S/C9H11N.2Rh/c1-7(2)9-4-8(3)5-10-6-9;;/h6-7H,1-3H3;;/q-2;;
InChIKeyLMXYEKJNGNOHOG-UHFFFAOYSA-N
XLogP2.11
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.01
LogP ≤ 52.11
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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Related Compounds

3-methyl-5-propan-2-yl-2H-pyridin-2-ide;yttrium
CID 57554353
carbanide;5-propan-2-yl-2H-pyridin-2-ide;tungsten(2+)
CID 57856119
3-Propan-2-yl-2,5-dihydropyridine-2,5-diide;bis(rhodium)
CID 58126723
5-propan-2-yl-2H-pyridin-2-ide;rhodium
CID 58126745
3-Propan-2-yl-2,4-dihydropyridine-2,4-diide;bis(rhodium)
CID 58126753
5-propan-2-yl-3H-pyridin-3-ide;rhodium
CID 58126788
5-propan-2-yl-2H-pyridin-2-ide;yttrium
CID 59265938
3-Methyl-4-propan-2-yl-2,5-dihydropyridine-2,5-diide;tungsten
CID 59686857
4,7-Dimethyl-6,7-dihydroisoquinoline
CID 89495216
(3E)-4-methylidene-3-(4-methylpent-1-en-3-ylidene)pyridine
CID 89533738
N-ethenyl-6-methylidene-4-propan-2-ylcyclohexa-2,4-dien-1-imine
CID 90931785
(7S)-4,7-dimethyl-6,7-dihydroisoquinoline
CID 117903842

Frequently Asked Questions

What is the IUPAC name of 3-methyl-5-propan-2-yl-2,4-dihydropyridine-2,4-diide;bis(rhodium)?
The IUPAC name of 3-methyl-5-propan-2-yl-2,4-dihydropyridine-2,4-diide;bis(rhodium) (CID 58126729) is 3-methyl-5-propan-2-yl-2,4-dihydropyridine-2,4-diide;bis(rhodium).
What is the SMILES notation for 3-methyl-5-propan-2-yl-2,4-dihydropyridine-2,4-diide;bis(rhodium)?
The canonical SMILES for 3-methyl-5-propan-2-yl-2,4-dihydropyridine-2,4-diide;bis(rhodium) is Cc1[c-]ncc(C(C)C)[c-]1.[Rh].[Rh].
What is the InChIKey of 3-methyl-5-propan-2-yl-2,4-dihydropyridine-2,4-diide;bis(rhodium)?
The InChIKey is LMXYEKJNGNOHOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11N.2Rh/c1-7(2)9-4-8(3)5-10-6-9;;/h6-7H,1-3H3;;/q-2;;.
What are the key properties of 3-methyl-5-propan-2-yl-2,4-dihydropyridine-2,4-diide;bis(rhodium)?
3-methyl-5-propan-2-yl-2,4-dihydropyridine-2,4-diide;bis(rhodium) has a molecular weight of 339.01 g/mol, XLogP of 2.11, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-5-propan-2-yl-2,4-dihydropyridine-2,4-diide;bis(rhodium) is sourced from PubChem (CID 58126729), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).