2,2-dimethylpropylbenzene;2,2-dimethylpropylbenzene;2-(2,2-dimethylpropyl)-4H-pyridin-4-ide;4-(2,2-dimethylpropyl)-2H-pyridin-2-ide;5-(2,2-dimethylpropyl)-2H-pyridin-2-ide;5-(2,2-dimethylpropyl)-3H-pyridin-3-ide;6-(2,2-dimethylpropyl)-3H-pyridin-3-ide;heptakis(2-methylpropane);tetradecakis(vanadium);heptakis(vanadium(2+))

C100H163N5V21 — CID 158409283

About 2,2-dimethylpropylbenzene;2,2-dimethylpropylbenzene;2-(2,2-dimethylpropyl)-4H-pyridin-4-ide;4-(2,2-dimethylpropyl)-2H-pyridin-2-ide;5-(2,2-dimethylpropyl)-2H-pyridin-2-ide;5-(2,2-dimethylpropyl)-3H-pyridin-3-ide;6-(2,2-dimethylpropyl)-3H-pyridin-3-ide;heptakis(2-methylpropane);tetradecakis(vanadium);heptakis(vanadium(2+))

2,2-dimethylpropylbenzene;2,2-dimethylpropylbenzene;2-(2,2-dimethylpropyl)-4H-pyridin-4-ide;4-(2,2-dimethylpropyl)-2H-pyridin-2-ide;5-(2,2-dimethylpropyl)-2H-pyridin-2-ide;5-(2,2-dimethylpropyl)-3H-pyridin-3-ide;6-(2,2-dimethylpropyl)-3H-pyridin-3-ide;heptakis(2-methylpropane);tetradecakis(vanadium);heptakis(vanadium(2+)) (PubChem CID 158409283) has the molecular formula C100H163N5V21 and a molecular weight of 2505.26 g/mol. Its IUPAC name is 2,2-dimethylpropylbenzene;2,2-dimethylpropylbenzene;2-(2,2-dimethylpropyl)-4H-pyridin-4-ide;4-(2,2-dimethylpropyl)-2H-pyridin-2-ide;5-(2,2-dimethylpropyl)-2H-pyridin-2-ide;5-(2,2-dimethylpropyl)-3H-pyridin-3-ide;6-(2,2-dimethylpropyl)-3H-pyridin-3-ide;heptakis(2-methylpropane);tetradecakis(vanadium);heptakis(vanadium(2+)).

Molecular Properties

• Compound Name: 2,2-dimethylpropylbenzene;2,2-dimethylpropylbenzene;2-(2,2-dimethylpropyl)-4H-pyridin-4-ide;4-(2,2-dimethylpropyl)-2H-pyridin-2-ide;5-(2,2-dimethylpropyl)-2H-pyridin-2-ide;5-(2,2-dimethylpropyl)-3H-pyridin-3-ide;6-(2,2-dimethylpropyl)-3H-pyridin-3-ide;heptakis(2-methylpropane);tetradecakis(vanadium);heptakis(vanadium(2+))
• PubChem CID: 158409283
• Molecular Formula: C100H163N5V21
• Molecular Weight: 2505.26 g/mol
• Exact Mass: 2504.11
• IUPAC Name: 2,2-dimethylpropylbenzene;2,2-dimethylpropylbenzene;2-(2,2-dimethylpropyl)-4H-pyridin-4-ide;4-(2,2-dimethylpropyl)-2H-pyridin-2-ide;5-(2,2-dimethylpropyl)-2H-pyridin-2-ide;5-(2,2-dimethylpropyl)-3H-pyridin-3-ide;6-(2,2-dimethylpropyl)-3H-pyridin-3-ide;heptakis(2-methylpropane);tetradecakis(vanadium);heptakis(vanadium(2+))
• SMILES: CC(C)(C)Cc1c[c-]ccc1.CC(C)(C)Cc1c[c-]ccn1.CC(C)(C)Cc1c[c-]cnc1.CC(C)(C)Cc1c[c-]ncc1.CC(C)(C)Cc1cc[c-]cc1.CC(C)(C)Cc1cc[c-]cn1.CC(C)(C)Cc1cc[c-]nc1.C[C-](C)C.C[C-](C)C.C[C-](C)C.C[C-](C)C.C[C-](C)C.C[C-](C)C.C[C-](C)C.[V+2].[V+2].[V+2].[V+2].[V+2].[V+2].[V+2].[V].[V].[V].[V].[V].[V].[V].[V].[V].[V].[V].[V].[V].[V]
• InChI: InChI=1S/2C11H15.5C10H14N.7C4H9.21V/c2*1-11(2,3)9-10-7-5-4-6-8-10;1-10(2,3)8-9-4-6-11-7-5-9;2*1-10(2,3)7-9-5-4-6-11-8-9;2*1-10(2,3)8-9-6-4-5-7-11-9;7*1-4(2)3;;;;;;;;;;;;;;;;;;;;;/h5-8H,9H2,1-3H3;4-5,7-8H,9H2,1-3H3;4-6H,8H2,1-3H3;5-6,8H,7H2,1-3H3;4-5,8H,7H2,1-3H3;5-7H,8H2,1-3H3;4,6-7H,8H2,1-3H3;7*1-3H3;;;;;;;;;;;;;;;;;;;;;/q14*-1;;;;;;;;;;;;;;;7*+2
• InChIKey: VTGQAYXGQCONRL-UHFFFAOYSA-N
• XLogP: 29.79
• TPSA: 64.45 Ų
• H-Bond Acceptors: 5
• Rotatable Bonds: 7
• Heavy Atoms: 126
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	2505.26
LogP ≤ 5	29.79
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	5

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 2,2-dimethylpropylbenzene;2,2-dimethylpropylbenzene;2-(2,2-dimethylpropyl)-4H-pyridin-4-ide;4-(2,2-dimethylpropyl)-2H-pyridin-2-ide;5-(2,2-dimethylpropyl)-2H-pyridin-2-ide;5-(2,2-dimethylpropyl)-3H-pyridin-3-ide;6-(2,2-dimethylpropyl)-3H-pyridin-3-ide;heptakis(2-methylpropane);tetradecakis(vanadium);heptakis(vanadium(2+))?

The IUPAC name of 2,2-dimethylpropylbenzene;2,2-dimethylpropylbenzene;2-(2,2-dimethylpropyl)-4H-pyridin-4-ide;4-(2,2-dimethylpropyl)-2H-pyridin-2-ide;5-(2,2-dimethylpropyl)-2H-pyridin-2-ide;5-(2,2-dimethylpropyl)-3H-pyridin-3-ide;6-(2,2-dimethylpropyl)-3H-pyridin-3-ide;heptakis(2-methylpropane);tetradecakis(vanadium);heptakis(vanadium(2+)) (CID 158409283) is 2,2-dimethylpropylbenzene;2,2-dimethylpropylbenzene;2-(2,2-dimethylpropyl)-4H-pyridin-4-ide;4-(2,2-dimethylpropyl)-2H-pyridin-2-ide;5-(2,2-dimethylpropyl)-2H-pyridin-2-ide;5-(2,2-dimethylpropyl)-3H-pyridin-3-ide;6-(2,2-dimethylpropyl)-3H-pyridin-3-ide;heptakis(2-methylpropane);tetradecakis(vanadium);heptakis(vanadium(2+)).

What is the SMILES notation for 2,2-dimethylpropylbenzene;2,2-dimethylpropylbenzene;2-(2,2-dimethylpropyl)-4H-pyridin-4-ide;4-(2,2-dimethylpropyl)-2H-pyridin-2-ide;5-(2,2-dimethylpropyl)-2H-pyridin-2-ide;5-(2,2-dimethylpropyl)-3H-pyridin-3-ide;6-(2,2-dimethylpropyl)-3H-pyridin-3-ide;heptakis(2-methylpropane);tetradecakis(vanadium);heptakis(vanadium(2+))?

The canonical SMILES for 2,2-dimethylpropylbenzene;2,2-dimethylpropylbenzene;2-(2,2-dimethylpropyl)-4H-pyridin-4-ide;4-(2,2-dimethylpropyl)-2H-pyridin-2-ide;5-(2,2-dimethylpropyl)-2H-pyridin-2-ide;5-(2,2-dimethylpropyl)-3H-pyridin-3-ide;6-(2,2-dimethylpropyl)-3H-pyridin-3-ide;heptakis(2-methylpropane);tetradecakis(vanadium);heptakis(vanadium(2+)) is CC(C)(C)Cc1c[c-]ccc1.CC(C)(C)Cc1c[c-]ccn1.CC(C)(C)Cc1c[c-]cnc1.CC(C)(C)Cc1c[c-]ncc1.CC(C)(C)Cc1cc[c-]cc1.CC(C)(C)Cc1cc[c-]cn1.CC(C)(C)Cc1cc[c-]nc1.C[C-](C)C.C[C-](C)C.C[C-](C)C.C[C-](C)C.C[C-](C)C.C[C-](C)C.C[C-](C)C.[V+2].[V+2].[V+2].[V+2].[V+2].[V+2].[V+2].[V].[V].[V].[V].[V].[V].[V].[V].[V].[V].[V].[V].[V].[V].

What is the InChIKey of 2,2-dimethylpropylbenzene;2,2-dimethylpropylbenzene;2-(2,2-dimethylpropyl)-4H-pyridin-4-ide;4-(2,2-dimethylpropyl)-2H-pyridin-2-ide;5-(2,2-dimethylpropyl)-2H-pyridin-2-ide;5-(2,2-dimethylpropyl)-3H-pyridin-3-ide;6-(2,2-dimethylpropyl)-3H-pyridin-3-ide;heptakis(2-methylpropane);tetradecakis(vanadium);heptakis(vanadium(2+))?

The InChIKey is VTGQAYXGQCONRL-UHFFFAOYSA-N. The full InChI is InChI=1S/2C11H15.5C10H14N.7C4H9.21V/c2*1-11(2,3)9-10-7-5-4-6-8-10;1-10(2,3)8-9-4-6-11-7-5-9;2*1-10(2,3)7-9-5-4-6-11-8-9;2*1-10(2,3)8-9-6-4-5-7-11-9;7*1-4(2)3;;;;;;;;;;;;;;;;;;;;;/h5-8H,9H2,1-3H3;4-5,7-8H,9H2,1-3H3;4-6H,8H2,1-3H3;5-6,8H,7H2,1-3H3;4-5,8H,7H2,1-3H3;5-7H,8H2,1-3H3;4,6-7H,8H2,1-3H3;7*1-3H3;;;;;;;;;;;;;;;;;;;;;/q14*-1;;;;;;;;;;;;;;;7*+2.

What are the key properties of 2,2-dimethylpropylbenzene;2,2-dimethylpropylbenzene;2-(2,2-dimethylpropyl)-4H-pyridin-4-ide;4-(2,2-dimethylpropyl)-2H-pyridin-2-ide;5-(2,2-dimethylpropyl)-2H-pyridin-2-ide;5-(2,2-dimethylpropyl)-3H-pyridin-3-ide;6-(2,2-dimethylpropyl)-3H-pyridin-3-ide;heptakis(2-methylpropane);tetradecakis(vanadium);heptakis(vanadium(2+))?

2,2-dimethylpropylbenzene;2,2-dimethylpropylbenzene;2-(2,2-dimethylpropyl)-4H-pyridin-4-ide;4-(2,2-dimethylpropyl)-2H-pyridin-2-ide;5-(2,2-dimethylpropyl)-2H-pyridin-2-ide;5-(2,2-dimethylpropyl)-3H-pyridin-3-ide;6-(2,2-dimethylpropyl)-3H-pyridin-3-ide;heptakis(2-methylpropane);tetradecakis(vanadium);heptakis(vanadium(2+)) has a molecular weight of 2505.26 g/mol, XLogP of 29.79, 7 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for 2,2-dimethylpropylbenzene;2,2-dimethylpropylbenzene;2-(2,2-dimethylpropyl)-4H-pyridin-4-ide;4-(2,2-dimethylpropyl)-2H-pyridin-2-ide;5-(2,2-dimethylpropyl)-2H-pyridin-2-ide;5-(2,2-dimethylpropyl)-3H-pyridin-3-ide;6-(2,2-dimethylpropyl)-3H-pyridin-3-ide;heptakis(2-methylpropane);tetradecakis(vanadium);heptakis(vanadium(2+)) is sourced from PubChem (CID 158409283), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).