tris(1-carbamimidoylguanidine);cobalt(3+)

C6H21CoN15+3 — CID 135534766

IUPACtris(1-carbamimidoylguanidine);cobalt(3+)
SMILES[Co+3].[H]/N=C(\N)N/C(N)=N/[H].[H]/N=C(\N)N/C(N)=N/[H].[H]/N=C(\N)N/C(N)=N/[H]
InChIInChI=1S/3C2H7N5.Co/c3*3-1(4)7-2(5)6;/h3*(H7,3,4,5,6,7);/q;;;+3
InChIKeyRXLWMDAIXIKZMW-UHFFFAOYSA-N
MW362.27 g/mol
LogP-4.91
Rot. Bonds

About tris(1-carbamimidoylguanidine);cobalt(3+)

tris(1-carbamimidoylguanidine);cobalt(3+) (PubChem CID 135534766) has the molecular formula C6H21CoN15+3 and a molecular weight of 362.27 g/mol. Its IUPAC name is tris(1-carbamimidoylguanidine);cobalt(3+).

Molecular Properties

Compound Nametris(1-carbamimidoylguanidine);cobalt(3+)
PubChem CID135534766
Molecular FormulaC6H21CoN15+3
Molecular Weight362.27 g/mol
Exact Mass362.14
IUPAC Nametris(1-carbamimidoylguanidine);cobalt(3+)
SMILES[Co+3].[H]/N=C(\N)N/C(N)=N/[H].[H]/N=C(\N)N/C(N)=N/[H].[H]/N=C(\N)N/C(N)=N/[H]
InChIInChI=1S/3C2H7N5.Co/c3*3-1(4)7-2(5)6;/h3*(H7,3,4,5,6,7);/q;;;+3
InChIKeyRXLWMDAIXIKZMW-UHFFFAOYSA-N
XLogP-4.91
TPSA335.31 Ų
H-Bond Donors15
H-Bond Acceptors6
Rotatable Bonds
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500362.27
LogP ≤ 5-4.91
H-Bond Donors ≤ 515
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Related Compounds

1-carbamimidoylguanidine;methane
CID 176544517
bis(1-carbamimidoylguanidine);dihydrochloride
CID 176545553
1-carbamimidoylguanidine;oxovanadium(2+)
CID 176523770
1-carbamimidoylguanidine;ethane;dihydrate
CID 176527155
1-carbamimidoylguanidine;prop-1-ene
CID 176521577
1-carbamimidoylguanidine;octanedioic acid
CID 176518629
1-carbamimidamidoguanidine;hydrobromide
CID 176518952
1-carbamimidoyl-2-methylguanidine;hydrochloride
CID 176516778
2-[8-[[amino(carbamimidamido)methylidene]amino]octyl]-1-carbamimidoylguanidine
CID 176524022
1-carbamimidoyl-2-(1,1-dichloroethyl)guanidine
CID 176527824
1-carbamimidoylguanidine;chlorobenzene;piperazine
CID 176529495
2-[1-[[amino(carbamimidamido)methylidene]amino]propyl]-1-carbamimidoylguanidine
CID 176524679

Frequently Asked Questions

What is the IUPAC name of tris(1-carbamimidoylguanidine);cobalt(3+)?
The IUPAC name of tris(1-carbamimidoylguanidine);cobalt(3+) (CID 135534766) is tris(1-carbamimidoylguanidine);cobalt(3+).
What is the SMILES notation for tris(1-carbamimidoylguanidine);cobalt(3+)?
The canonical SMILES for tris(1-carbamimidoylguanidine);cobalt(3+) is [Co+3].[H]/N=C(\N)N/C(N)=N/[H].[H]/N=C(\N)N/C(N)=N/[H].[H]/N=C(\N)N/C(N)=N/[H].
What is the InChIKey of tris(1-carbamimidoylguanidine);cobalt(3+)?
The InChIKey is RXLWMDAIXIKZMW-UHFFFAOYSA-N. The full InChI is InChI=1S/3C2H7N5.Co/c3*3-1(4)7-2(5)6;/h3*(H7,3,4,5,6,7);/q;;;+3.
What are the key properties of tris(1-carbamimidoylguanidine);cobalt(3+)?
tris(1-carbamimidoylguanidine);cobalt(3+) has a molecular weight of 362.27 g/mol, XLogP of -4.91, 0 rotatable bonds, 15 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for tris(1-carbamimidoylguanidine);cobalt(3+) is sourced from PubChem (CID 135534766), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).