cobalt;2-cyclopenta-2,4-dien-1-yl-N,N-dimethylethanamine;3-di(propan-2-yl)phosphaniumylpropyl-di(propan-2-yl)phosphanium

C24H50CoNP2+ — CID 11987342

IUPACcobalt;2-cyclopenta-2,4-dien-1-yl-N,N-dimethylethanamine;3-di(propan-2-yl)phosphaniumylpropyl-di(propan-2-yl)phosphanium
SMILESCC(C)[PH+](CCC[PH+](C(C)C)C(C)C)C(C)C.CN(C)CC[c-]1cccc1.[Co]
InChIInChI=1S/C15H34P2.C9H14N.Co/c1-12(2)16(13(3)4)10-9-11-17(14(5)6)15(7)8;1-10(2)8-7-9-5-3-4-6-9;/h12-15H,9-11H2,1-8H3;3-6H,7-8H2,1-2H3;/q;-1;/p+2
InChIKeyNPLFZZBUBWTUKD-UHFFFAOYSA-P
MW473.55 g/mol
LogP6.95
Rot. Bonds11

About cobalt;2-cyclopenta-2,4-dien-1-yl-N,N-dimethylethanamine;3-di(propan-2-yl)phosphaniumylpropyl-di(propan-2-yl)phosphanium

cobalt;2-cyclopenta-2,4-dien-1-yl-N,N-dimethylethanamine;3-di(propan-2-yl)phosphaniumylpropyl-di(propan-2-yl)phosphanium (PubChem CID 11987342) has the molecular formula C24H50CoNP2+ and a molecular weight of 473.55 g/mol. Its IUPAC name is cobalt;2-cyclopenta-2,4-dien-1-yl-N,N-dimethylethanamine;3-di(propan-2-yl)phosphaniumylpropyl-di(propan-2-yl)phosphanium.

Molecular Properties

Compound Namecobalt;2-cyclopenta-2,4-dien-1-yl-N,N-dimethylethanamine;3-di(propan-2-yl)phosphaniumylpropyl-di(propan-2-yl)phosphanium
PubChem CID11987342
Molecular FormulaC24H50CoNP2+
Molecular Weight473.55 g/mol
Exact Mass473.27
IUPAC Namecobalt;2-cyclopenta-2,4-dien-1-yl-N,N-dimethylethanamine;3-di(propan-2-yl)phosphaniumylpropyl-di(propan-2-yl)phosphanium
SMILESCC(C)[PH+](CCC[PH+](C(C)C)C(C)C)C(C)C.CN(C)CC[c-]1cccc1.[Co]
InChIInChI=1S/C15H34P2.C9H14N.Co/c1-12(2)16(13(3)4)10-9-11-17(14(5)6)15(7)8;1-10(2)8-7-9-5-3-4-6-9;/h12-15H,9-11H2,1-8H3;3-6H,7-8H2,1-2H3;/q;-1;/p+2
InChIKeyNPLFZZBUBWTUKD-UHFFFAOYSA-P
XLogP6.95
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds11
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500473.55
LogP ≤ 56.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze cobalt;2-cyclopenta-2,4-dien-1-yl-N,N-dimethylethanamine;3-di(propan-2-yl)phosphaniumylpropyl-di(propan-2-yl)phosphanium with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

potassium 2-cyclopenta-2,4-dien-1-yl-N,N-dimethylethanamine
CID 15393928
cyclopenta-1,3-diene;2-cyclopenta-2,4-dien-1-yl-N,N-dimethylethanamine;zirconium(4+);dichloride
CID 159810110
1,1'-biphenyl;3-cyclopenta-2,4-dien-1-yl-N,N-dimethylpropan-1-amine;manganese
CID 11986694
bis(5-propylcyclopenta-1,3-diene);titanium(2+)
CID 154426293
5-propylcyclopenta-1,3-diene;zirconium(3+);dichloride
CID 175833088
bis(2-cyclopenta-2,4-dien-1-ylethyl(trimethyl)silane);hafnium
CID 154404293
cyclopenta-1,3-diene;1-cyclopenta-2,4-dien-1-yl-N,N-dimethylmethanamine;ruthenium(2+)
CID 15807877
bis(5-(2-methylpropyl)cyclopenta-1,3-diene);titanium(4+);difluoride
CID 157341345
1-cyclopenta-2,4-dien-1-yl-N,N-dimethylmethanamine;iron;methylcyclopentane
CID 175522036
potassium 2-cyclopenta-2,4-dien-1-ylethanamine
CID 130018757
tris(dimethylazanide);hafnium(4+);5-(2-methylpropyl)cyclopenta-1,3-diene
CID 155667440
bis(cyclopenta-2,4-dien-1-ylmethyl(trimethyl)silane);hafnium(4+)
CID 175757243

Frequently Asked Questions

What is the IUPAC name of cobalt;2-cyclopenta-2,4-dien-1-yl-N,N-dimethylethanamine;3-di(propan-2-yl)phosphaniumylpropyl-di(propan-2-yl)phosphanium?
The IUPAC name of cobalt;2-cyclopenta-2,4-dien-1-yl-N,N-dimethylethanamine;3-di(propan-2-yl)phosphaniumylpropyl-di(propan-2-yl)phosphanium (CID 11987342) is cobalt;2-cyclopenta-2,4-dien-1-yl-N,N-dimethylethanamine;3-di(propan-2-yl)phosphaniumylpropyl-di(propan-2-yl)phosphanium.
What is the SMILES notation for cobalt;2-cyclopenta-2,4-dien-1-yl-N,N-dimethylethanamine;3-di(propan-2-yl)phosphaniumylpropyl-di(propan-2-yl)phosphanium?
The canonical SMILES for cobalt;2-cyclopenta-2,4-dien-1-yl-N,N-dimethylethanamine;3-di(propan-2-yl)phosphaniumylpropyl-di(propan-2-yl)phosphanium is CC(C)[PH+](CCC[PH+](C(C)C)C(C)C)C(C)C.CN(C)CC[c-]1cccc1.[Co].
What is the InChIKey of cobalt;2-cyclopenta-2,4-dien-1-yl-N,N-dimethylethanamine;3-di(propan-2-yl)phosphaniumylpropyl-di(propan-2-yl)phosphanium?
The InChIKey is NPLFZZBUBWTUKD-UHFFFAOYSA-P. The full InChI is InChI=1S/C15H34P2.C9H14N.Co/c1-12(2)16(13(3)4)10-9-11-17(14(5)6)15(7)8;1-10(2)8-7-9-5-3-4-6-9;/h12-15H,9-11H2,1-8H3;3-6H,7-8H2,1-2H3;/q;-1;/p+2.
What are the key properties of cobalt;2-cyclopenta-2,4-dien-1-yl-N,N-dimethylethanamine;3-di(propan-2-yl)phosphaniumylpropyl-di(propan-2-yl)phosphanium?
cobalt;2-cyclopenta-2,4-dien-1-yl-N,N-dimethylethanamine;3-di(propan-2-yl)phosphaniumylpropyl-di(propan-2-yl)phosphanium has a molecular weight of 473.55 g/mol, XLogP of 6.95, 11 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for cobalt;2-cyclopenta-2,4-dien-1-yl-N,N-dimethylethanamine;3-di(propan-2-yl)phosphaniumylpropyl-di(propan-2-yl)phosphanium is sourced from PubChem (CID 11987342), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).