carbanide;6,7,9,10-tetramethyl-5-azoniaspiro[4.5]decane;6,8,9,10-tetramethyl-5-azoniaspiro[4.5]decane;7,8,9,10-tetramethyl-5-azoniaspiro[4.5]decane;6,8,10-trimethyl-5-azoniaspiro[4.5]decane;6,9,10-trimethyl-5-azoniaspiro[4.5]decane;7,8,9-trimethyl-5-azoniaspiro[4.5]decane;7,8,10-trimethyl-5-azoniaspiro[4.5]decane

C94H195N7 — CID 158202630

IUPACcarbanide;6,7,9,10-tetramethyl-5-azoniaspiro[4.5]decane;6,8,9,10-tetramethyl-5-azoniaspiro[4.5]decane;7,8,9,10-tetramethyl-5-azoniaspiro[4.5]decane;6,8,10-trimethyl-5-azoniaspiro[4.5]decane;6,9,10-trimethyl-5-azoniaspiro[4.5]decane;7,8,9-trimethyl-5-azoniaspiro[4.5]decane;7,8,10-trimethyl-5-azoniaspiro[4.5]decane
SMILESCC1CC(C)C(C)[N+]2(CCCC2)C1C.CC1CC(C)[N+]2(CCCC2)C(C)C1.CC1CC(C)[N+]2(CCCC2)C(C)C1C.CC1CC(C)[N+]2(CCCC2)CC1C.CC1CCC(C)[N+]2(CCCC2)C1C.CC1C[N+]2(CCCC2)C(C)C(C)C1C.CC1C[N+]2(CCCC2)CC(C)C1C.[CH3-].[CH3-].[CH3-].[CH3-].[CH3-].[CH3-].[CH3-]
InChIInChI=1S/3C13H26N.4C12H24N.7CH3/c1-10-9-14(7-5-6-8-14)13(4)12(3)11(10)2;1-10-9-11(2)14(7-5-6-8-14)13(4)12(10)3;1-10-9-11(2)13(4)14(12(10)3)7-5-6-8-14;1-10-6-7-11(2)13(12(10)3)8-4-5-9-13;1-10-8-13(6-4-5-7-13)9-11(2)12(10)3;1-10-8-12(3)13(9-11(10)2)6-4-5-7-13;1-10-8-11(2)13(12(3)9-10)6-4-5-7-13;;;;;;;/h3*10-13H,5-9H2,1-4H3;4*10-12H,4-9H2,1-3H3;7*1H3/q7*+1;7*-1
InChIKeyXUHAKXMARXHWDV-UHFFFAOYSA-N
MW1423.64 g/mol
LogP22.95
Rot. Bonds

About carbanide;6,7,9,10-tetramethyl-5-azoniaspiro[4.5]decane;6,8,9,10-tetramethyl-5-azoniaspiro[4.5]decane;7,8,9,10-tetramethyl-5-azoniaspiro[4.5]decane;6,8,10-trimethyl-5-azoniaspiro[4.5]decane;6,9,10-trimethyl-5-azoniaspiro[4.5]decane;7,8,9-trimethyl-5-azoniaspiro[4.5]decane;7,8,10-trimethyl-5-azoniaspiro[4.5]decane

carbanide;6,7,9,10-tetramethyl-5-azoniaspiro[4.5]decane;6,8,9,10-tetramethyl-5-azoniaspiro[4.5]decane;7,8,9,10-tetramethyl-5-azoniaspiro[4.5]decane;6,8,10-trimethyl-5-azoniaspiro[4.5]decane;6,9,10-trimethyl-5-azoniaspiro[4.5]decane;7,8,9-trimethyl-5-azoniaspiro[4.5]decane;7,8,10-trimethyl-5-azoniaspiro[4.5]decane (PubChem CID 158202630) has the molecular formula C94H195N7 and a molecular weight of 1423.64 g/mol. Its IUPAC name is carbanide;6,7,9,10-tetramethyl-5-azoniaspiro[4.5]decane;6,8,9,10-tetramethyl-5-azoniaspiro[4.5]decane;7,8,9,10-tetramethyl-5-azoniaspiro[4.5]decane;6,8,10-trimethyl-5-azoniaspiro[4.5]decane;6,9,10-trimethyl-5-azoniaspiro[4.5]decane;7,8,9-trimethyl-5-azoniaspiro[4.5]decane;7,8,10-trimethyl-5-azoniaspiro[4.5]decane.

Molecular Properties

Compound Namecarbanide;6,7,9,10-tetramethyl-5-azoniaspiro[4.5]decane;6,8,9,10-tetramethyl-5-azoniaspiro[4.5]decane;7,8,9,10-tetramethyl-5-azoniaspiro[4.5]decane;6,8,10-trimethyl-5-azoniaspiro[4.5]decane;6,9,10-trimethyl-5-azoniaspiro[4.5]decane;7,8,9-trimethyl-5-azoniaspiro[4.5]decane;7,8,10-trimethyl-5-azoniaspiro[4.5]decane
PubChem CID158202630
Molecular FormulaC94H195N7
Molecular Weight1423.64 g/mol
Exact Mass1422.55
IUPAC Namecarbanide;6,7,9,10-tetramethyl-5-azoniaspiro[4.5]decane;6,8,9,10-tetramethyl-5-azoniaspiro[4.5]decane;7,8,9,10-tetramethyl-5-azoniaspiro[4.5]decane;6,8,10-trimethyl-5-azoniaspiro[4.5]decane;6,9,10-trimethyl-5-azoniaspiro[4.5]decane;7,8,9-trimethyl-5-azoniaspiro[4.5]decane;7,8,10-trimethyl-5-azoniaspiro[4.5]decane
SMILESCC1CC(C)C(C)[N+]2(CCCC2)C1C.CC1CC(C)[N+]2(CCCC2)C(C)C1.CC1CC(C)[N+]2(CCCC2)C(C)C1C.CC1CC(C)[N+]2(CCCC2)CC1C.CC1CCC(C)[N+]2(CCCC2)C1C.CC1C[N+]2(CCCC2)C(C)C(C)C1C.CC1C[N+]2(CCCC2)CC(C)C1C.[CH3-].[CH3-].[CH3-].[CH3-].[CH3-].[CH3-].[CH3-]
InChIInChI=1S/3C13H26N.4C12H24N.7CH3/c1-10-9-14(7-5-6-8-14)13(4)12(3)11(10)2;1-10-9-11(2)14(7-5-6-8-14)13(4)12(10)3;1-10-9-11(2)13(4)14(12(10)3)7-5-6-8-14;1-10-6-7-11(2)13(12(10)3)8-4-5-9-13;1-10-8-13(6-4-5-7-13)9-11(2)12(10)3;1-10-8-12(3)13(9-11(10)2)6-4-5-7-13;1-10-8-11(2)13(12(3)9-10)6-4-5-7-13;;;;;;;/h3*10-13H,5-9H2,1-4H3;4*10-12H,4-9H2,1-3H3;7*1H3/q7*+1;7*-1
InChIKeyXUHAKXMARXHWDV-UHFFFAOYSA-N
XLogP22.95
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms101
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001423.64
LogP ≤ 522.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_2', 'substructure': 'N/A'}

Analyze carbanide;6,7,9,10-tetramethyl-5-azoniaspiro[4.5]decane;6,8,9,10-tetramethyl-5-azoniaspiro[4.5]decane;7,8,9,10-tetramethyl-5-azoniaspiro[4.5]decane;6,8,10-trimethyl-5-azoniaspiro[4.5]decane;6,9,10-trimethyl-5-azoniaspiro[4.5]decane;7,8,9-trimethyl-5-azoniaspiro[4.5]decane;7,8,10-trimethyl-5-azoniaspiro[4.5]decane with MolForge

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Related Compounds

Frequently Asked Questions

What is the IUPAC name of carbanide;6,7,9,10-tetramethyl-5-azoniaspiro[4.5]decane;6,8,9,10-tetramethyl-5-azoniaspiro[4.5]decane;7,8,9,10-tetramethyl-5-azoniaspiro[4.5]decane;6,8,10-trimethyl-5-azoniaspiro[4.5]decane;6,9,10-trimethyl-5-azoniaspiro[4.5]decane;7,8,9-trimethyl-5-azoniaspiro[4.5]decane;7,8,10-trimethyl-5-azoniaspiro[4.5]decane?
The IUPAC name of carbanide;6,7,9,10-tetramethyl-5-azoniaspiro[4.5]decane;6,8,9,10-tetramethyl-5-azoniaspiro[4.5]decane;7,8,9,10-tetramethyl-5-azoniaspiro[4.5]decane;6,8,10-trimethyl-5-azoniaspiro[4.5]decane;6,9,10-trimethyl-5-azoniaspiro[4.5]decane;7,8,9-trimethyl-5-azoniaspiro[4.5]decane;7,8,10-trimethyl-5-azoniaspiro[4.5]decane (CID 158202630) is carbanide;6,7,9,10-tetramethyl-5-azoniaspiro[4.5]decane;6,8,9,10-tetramethyl-5-azoniaspiro[4.5]decane;7,8,9,10-tetramethyl-5-azoniaspiro[4.5]decane;6,8,10-trimethyl-5-azoniaspiro[4.5]decane;6,9,10-trimethyl-5-azoniaspiro[4.5]decane;7,8,9-trimethyl-5-azoniaspiro[4.5]decane;7,8,10-trimethyl-5-azoniaspiro[4.5]decane.
What is the SMILES notation for carbanide;6,7,9,10-tetramethyl-5-azoniaspiro[4.5]decane;6,8,9,10-tetramethyl-5-azoniaspiro[4.5]decane;7,8,9,10-tetramethyl-5-azoniaspiro[4.5]decane;6,8,10-trimethyl-5-azoniaspiro[4.5]decane;6,9,10-trimethyl-5-azoniaspiro[4.5]decane;7,8,9-trimethyl-5-azoniaspiro[4.5]decane;7,8,10-trimethyl-5-azoniaspiro[4.5]decane?
The canonical SMILES for carbanide;6,7,9,10-tetramethyl-5-azoniaspiro[4.5]decane;6,8,9,10-tetramethyl-5-azoniaspiro[4.5]decane;7,8,9,10-tetramethyl-5-azoniaspiro[4.5]decane;6,8,10-trimethyl-5-azoniaspiro[4.5]decane;6,9,10-trimethyl-5-azoniaspiro[4.5]decane;7,8,9-trimethyl-5-azoniaspiro[4.5]decane;7,8,10-trimethyl-5-azoniaspiro[4.5]decane is CC1CC(C)C(C)[N+]2(CCCC2)C1C.CC1CC(C)[N+]2(CCCC2)C(C)C1.CC1CC(C)[N+]2(CCCC2)C(C)C1C.CC1CC(C)[N+]2(CCCC2)CC1C.CC1CCC(C)[N+]2(CCCC2)C1C.CC1C[N+]2(CCCC2)C(C)C(C)C1C.CC1C[N+]2(CCCC2)CC(C)C1C.[CH3-].[CH3-].[CH3-].[CH3-].[CH3-].[CH3-].[CH3-].
What is the InChIKey of carbanide;6,7,9,10-tetramethyl-5-azoniaspiro[4.5]decane;6,8,9,10-tetramethyl-5-azoniaspiro[4.5]decane;7,8,9,10-tetramethyl-5-azoniaspiro[4.5]decane;6,8,10-trimethyl-5-azoniaspiro[4.5]decane;6,9,10-trimethyl-5-azoniaspiro[4.5]decane;7,8,9-trimethyl-5-azoniaspiro[4.5]decane;7,8,10-trimethyl-5-azoniaspiro[4.5]decane?
The InChIKey is XUHAKXMARXHWDV-UHFFFAOYSA-N. The full InChI is InChI=1S/3C13H26N.4C12H24N.7CH3/c1-10-9-14(7-5-6-8-14)13(4)12(3)11(10)2;1-10-9-11(2)14(7-5-6-8-14)13(4)12(10)3;1-10-9-11(2)13(4)14(12(10)3)7-5-6-8-14;1-10-6-7-11(2)13(12(10)3)8-4-5-9-13;1-10-8-13(6-4-5-7-13)9-11(2)12(10)3;1-10-8-12(3)13(9-11(10)2)6-4-5-7-13;1-10-8-11(2)13(12(3)9-10)6-4-5-7-13;;;;;;;/h3*10-13H,5-9H2,1-4H3;4*10-12H,4-9H2,1-3H3;7*1H3/q7*+1;7*-1.
What are the key properties of carbanide;6,7,9,10-tetramethyl-5-azoniaspiro[4.5]decane;6,8,9,10-tetramethyl-5-azoniaspiro[4.5]decane;7,8,9,10-tetramethyl-5-azoniaspiro[4.5]decane;6,8,10-trimethyl-5-azoniaspiro[4.5]decane;6,9,10-trimethyl-5-azoniaspiro[4.5]decane;7,8,9-trimethyl-5-azoniaspiro[4.5]decane;7,8,10-trimethyl-5-azoniaspiro[4.5]decane?
carbanide;6,7,9,10-tetramethyl-5-azoniaspiro[4.5]decane;6,8,9,10-tetramethyl-5-azoniaspiro[4.5]decane;7,8,9,10-tetramethyl-5-azoniaspiro[4.5]decane;6,8,10-trimethyl-5-azoniaspiro[4.5]decane;6,9,10-trimethyl-5-azoniaspiro[4.5]decane;7,8,9-trimethyl-5-azoniaspiro[4.5]decane;7,8,10-trimethyl-5-azoniaspiro[4.5]decane has a molecular weight of 1423.64 g/mol, XLogP of 22.95, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for carbanide;6,7,9,10-tetramethyl-5-azoniaspiro[4.5]decane;6,8,9,10-tetramethyl-5-azoniaspiro[4.5]decane;7,8,9,10-tetramethyl-5-azoniaspiro[4.5]decane;6,8,10-trimethyl-5-azoniaspiro[4.5]decane;6,9,10-trimethyl-5-azoniaspiro[4.5]decane;7,8,9-trimethyl-5-azoniaspiro[4.5]decane;7,8,10-trimethyl-5-azoniaspiro[4.5]decane is sourced from PubChem (CID 158202630), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).