carbanide;ethane;methane;propane;vanadium;vanadium(2+)

C84H240V2 — CID 160585798

IUPACcarbanide;ethane;methane;propane;vanadium;vanadium(2+)
SMILESC.C.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CCC.CCC.CCC.CCC.CCC.CCC.CCC.CCC.CCC.CCC.CCC.CCC.CCC.CCC.[CH3-].[CH3-].[V+2].[V]
InChIInChI=1S/14C3H8.19C2H6.2CH4.2CH3.2V/c14*1-3-2;19*1-2;;;;;;/h14*3H2,1-2H3;19*1-2H3;2*1H4;2*1H3;;/q;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;2*-1;;+2
InChIKeyRCJIUOPCOXQTQQ-UHFFFAOYSA-N
MW1352.73 g/mol
LogP41.49
Rot. Bonds

About carbanide;ethane;methane;propane;vanadium;vanadium(2+)

carbanide;ethane;methane;propane;vanadium;vanadium(2+) (PubChem CID 160585798) has the molecular formula C84H240V2 and a molecular weight of 1352.73 g/mol. Its IUPAC name is carbanide;ethane;methane;propane;vanadium;vanadium(2+).

Molecular Properties

Compound Namecarbanide;ethane;methane;propane;vanadium;vanadium(2+)
PubChem CID160585798
Molecular FormulaC84H240V2
Molecular Weight1352.73 g/mol
Exact Mass1351.77
IUPAC Namecarbanide;ethane;methane;propane;vanadium;vanadium(2+)
SMILESC.C.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CCC.CCC.CCC.CCC.CCC.CCC.CCC.CCC.CCC.CCC.CCC.CCC.CCC.CCC.[CH3-].[CH3-].[V+2].[V]
InChIInChI=1S/14C3H8.19C2H6.2CH4.2CH3.2V/c14*1-3-2;19*1-2;;;;;;/h14*3H2,1-2H3;19*1-2H3;2*1H4;2*1H3;;/q;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;2*-1;;+2
InChIKeyRCJIUOPCOXQTQQ-UHFFFAOYSA-N
XLogP41.49
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms86
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001352.73
LogP ≤ 541.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

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ethane;methane;propane
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ethane;methane;propane
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ethane;methane;propane
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ethane;methane;propane
CID 159652033
ethane;methane;propane
CID 141487287
CID 169429383
CID 169429383
methane;propane
CID 162082112
methane;propane
CID 160994941
carbanide;ethane;ethane;methane;propane;bis(tungsten(2+));hydrate
CID 159906494
ethane;methanamine;methane;propane
CID 143798923
azanide;carbanide;ethanamine;ethane;methane;vanadium(2+)
CID 157206789

Frequently Asked Questions

What is the IUPAC name of carbanide;ethane;methane;propane;vanadium;vanadium(2+)?
The IUPAC name of carbanide;ethane;methane;propane;vanadium;vanadium(2+) (CID 160585798) is carbanide;ethane;methane;propane;vanadium;vanadium(2+).
What is the SMILES notation for carbanide;ethane;methane;propane;vanadium;vanadium(2+)?
The canonical SMILES for carbanide;ethane;methane;propane;vanadium;vanadium(2+) is C.C.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CCC.CCC.CCC.CCC.CCC.CCC.CCC.CCC.CCC.CCC.CCC.CCC.CCC.CCC.[CH3-].[CH3-].[V+2].[V].
What is the InChIKey of carbanide;ethane;methane;propane;vanadium;vanadium(2+)?
The InChIKey is RCJIUOPCOXQTQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/14C3H8.19C2H6.2CH4.2CH3.2V/c14*1-3-2;19*1-2;;;;;;/h14*3H2,1-2H3;19*1-2H3;2*1H4;2*1H3;;/q;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;2*-1;;+2.
What are the key properties of carbanide;ethane;methane;propane;vanadium;vanadium(2+)?
carbanide;ethane;methane;propane;vanadium;vanadium(2+) has a molecular weight of 1352.73 g/mol, XLogP of 41.49, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for carbanide;ethane;methane;propane;vanadium;vanadium(2+) is sourced from PubChem (CID 160585798), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).