carbanide;bis(2,5-dimethyl-2,5-diazabicyclo[2.2.1]heptane);bis(3,6-dimethyl-3,6-diazabicyclo[3.1.1]heptane);bis(3,8-dimethyl-3,8-diazabicyclo[3.2.1]octane);bis(tungsten(2+))

C48H100N12W2 — CID 159714210

About carbanide;bis(2,5-dimethyl-2,5-diazabicyclo[2.2.1]heptane);bis(3,6-dimethyl-3,6-diazabicyclo[3.1.1]heptane);bis(3,8-dimethyl-3,8-diazabicyclo[3.2.1]octane);bis(tungsten(2+))

carbanide;bis(2,5-dimethyl-2,5-diazabicyclo[2.2.1]heptane);bis(3,6-dimethyl-3,6-diazabicyclo[3.1.1]heptane);bis(3,8-dimethyl-3,8-diazabicyclo[3.2.1]octane);bis(tungsten(2+)) (PubChem CID 159714210) has the molecular formula C48H100N12W2 and a molecular weight of 1213.09 g/mol. Its IUPAC name is carbanide;bis(2,5-dimethyl-2,5-diazabicyclo[2.2.1]heptane);bis(3,6-dimethyl-3,6-diazabicyclo[3.1.1]heptane);bis(3,8-dimethyl-3,8-diazabicyclo[3.2.1]octane);bis(tungsten(2+)).

Molecular Properties

• Compound Name: carbanide;bis(2,5-dimethyl-2,5-diazabicyclo[2.2.1]heptane);bis(3,6-dimethyl-3,6-diazabicyclo[3.1.1]heptane);bis(3,8-dimethyl-3,8-diazabicyclo[3.2.1]octane);bis(tungsten(2+))
• PubChem CID: 159714210
• Molecular Formula: C48H100N12W2
• Molecular Weight: 1213.09 g/mol
• Exact Mass: 1212.72
• IUPAC Name: carbanide;bis(2,5-dimethyl-2,5-diazabicyclo[2.2.1]heptane);bis(3,6-dimethyl-3,6-diazabicyclo[3.1.1]heptane);bis(3,8-dimethyl-3,8-diazabicyclo[3.2.1]octane);bis(tungsten(2+))
• SMILES: CN1CC2CC(C1)N2C.CN1CC2CC(C1)N2C.CN1CC2CC1CN2C.CN1CC2CC1CN2C.CN1CC2CCC(C1)N2C.CN1CC2CCC(C1)N2C.[CH3-].[CH3-].[CH3-].[CH3-].[W+2].[W+2]
• InChI: InChI=1S/2C8H16N2.4C7H14N2.4CH3.2W/c2*1-9-5-7-3-4-8(6-9)10(7)2;2*1-8-4-7-3-6(8)5-9(7)2;2*1-8-4-6-3-7(5-8)9(6)2;;;;;;/h2*7-8H,3-6H2,1-2H3;4*6-7H,3-5H2,1-2H3;4*1H3;;/q;;;;;;4*-1;2*+2
• InChIKey: MZFJQFVFKKSQFT-UHFFFAOYSA-N
• XLogP: 2.60
• TPSA: 38.88 Ų
• H-Bond Acceptors: 12
• Heavy Atoms: 62
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1213.09
LogP ≤ 5	2.60
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	12

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of carbanide;bis(2,5-dimethyl-2,5-diazabicyclo[2.2.1]heptane);bis(3,6-dimethyl-3,6-diazabicyclo[3.1.1]heptane);bis(3,8-dimethyl-3,8-diazabicyclo[3.2.1]octane);bis(tungsten(2+))?

The IUPAC name of carbanide;bis(2,5-dimethyl-2,5-diazabicyclo[2.2.1]heptane);bis(3,6-dimethyl-3,6-diazabicyclo[3.1.1]heptane);bis(3,8-dimethyl-3,8-diazabicyclo[3.2.1]octane);bis(tungsten(2+)) (CID 159714210) is carbanide;bis(2,5-dimethyl-2,5-diazabicyclo[2.2.1]heptane);bis(3,6-dimethyl-3,6-diazabicyclo[3.1.1]heptane);bis(3,8-dimethyl-3,8-diazabicyclo[3.2.1]octane);bis(tungsten(2+)).

What is the SMILES notation for carbanide;bis(2,5-dimethyl-2,5-diazabicyclo[2.2.1]heptane);bis(3,6-dimethyl-3,6-diazabicyclo[3.1.1]heptane);bis(3,8-dimethyl-3,8-diazabicyclo[3.2.1]octane);bis(tungsten(2+))?

The canonical SMILES for carbanide;bis(2,5-dimethyl-2,5-diazabicyclo[2.2.1]heptane);bis(3,6-dimethyl-3,6-diazabicyclo[3.1.1]heptane);bis(3,8-dimethyl-3,8-diazabicyclo[3.2.1]octane);bis(tungsten(2+)) is CN1CC2CC(C1)N2C.CN1CC2CC(C1)N2C.CN1CC2CC1CN2C.CN1CC2CC1CN2C.CN1CC2CCC(C1)N2C.CN1CC2CCC(C1)N2C.[CH3-].[CH3-].[CH3-].[CH3-].[W+2].[W+2].

What is the InChIKey of carbanide;bis(2,5-dimethyl-2,5-diazabicyclo[2.2.1]heptane);bis(3,6-dimethyl-3,6-diazabicyclo[3.1.1]heptane);bis(3,8-dimethyl-3,8-diazabicyclo[3.2.1]octane);bis(tungsten(2+))?

The InChIKey is MZFJQFVFKKSQFT-UHFFFAOYSA-N. The full InChI is InChI=1S/2C8H16N2.4C7H14N2.4CH3.2W/c2*1-9-5-7-3-4-8(6-9)10(7)2;2*1-8-4-7-3-6(8)5-9(7)2;2*1-8-4-6-3-7(5-8)9(6)2;;;;;;/h2*7-8H,3-6H2,1-2H3;4*6-7H,3-5H2,1-2H3;4*1H3;;/q;;;;;;4*-1;2*+2.

What are the key properties of carbanide;bis(2,5-dimethyl-2,5-diazabicyclo[2.2.1]heptane);bis(3,6-dimethyl-3,6-diazabicyclo[3.1.1]heptane);bis(3,8-dimethyl-3,8-diazabicyclo[3.2.1]octane);bis(tungsten(2+))?

carbanide;bis(2,5-dimethyl-2,5-diazabicyclo[2.2.1]heptane);bis(3,6-dimethyl-3,6-diazabicyclo[3.1.1]heptane);bis(3,8-dimethyl-3,8-diazabicyclo[3.2.1]octane);bis(tungsten(2+)) has a molecular weight of 1213.09 g/mol, XLogP of 2.60, 0 rotatable bonds, 0 hydrogen bond donors, and 12 hydrogen bond acceptors.

Where does this data come from?

All data for carbanide;bis(2,5-dimethyl-2,5-diazabicyclo[2.2.1]heptane);bis(3,6-dimethyl-3,6-diazabicyclo[3.1.1]heptane);bis(3,8-dimethyl-3,8-diazabicyclo[3.2.1]octane);bis(tungsten(2+)) is sourced from PubChem (CID 159714210), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).