2-[6-[[amino-(diaminomethylideneamino)methylidene]amino]hexyl]-1-(diaminomethylidene)guanidine

C10H24N10 — CID 516375

IUPAC2-[6-[[amino-(diaminomethylideneamino)methylidene]amino]hexyl]-1-(diaminomethylidene)guanidine
SMILESNC(N)=N/C(N)=N/CCCCCC/N=C(\N)N=C(N)N
InChIInChI=1S/C10H24N10/c11-7(12)19-9(15)17-5-3-1-2-4-6-18-10(16)20-8(13)14/h1-6H2,(H6,11,12,15,17,19)(H6,13,14,16,18,20)
InChIKeyRXGSAYBOEDPICZ-UHFFFAOYSA-N
MW284.37 g/mol
LogP-2.28
Rot. Bonds7

About 2-[6-[[amino-(diaminomethylideneamino)methylidene]amino]hexyl]-1-(diaminomethylidene)guanidine

2-[6-[[amino-(diaminomethylideneamino)methylidene]amino]hexyl]-1-(diaminomethylidene)guanidine (PubChem CID 516375) has the molecular formula C10H24N10 and a molecular weight of 284.37 g/mol. Its IUPAC name is 2-[6-[[amino-(diaminomethylideneamino)methylidene]amino]hexyl]-1-(diaminomethylidene)guanidine.

Molecular Properties

Compound Name2-[6-[[amino-(diaminomethylideneamino)methylidene]amino]hexyl]-1-(diaminomethylidene)guanidine
PubChem CID516375
Molecular FormulaC10H24N10
Molecular Weight284.37 g/mol
Exact Mass284.22
IUPAC Name2-[6-[[amino-(diaminomethylideneamino)methylidene]amino]hexyl]-1-(diaminomethylidene)guanidine
SMILESNC(N)=N/C(N)=N/CCCCCC/N=C(\N)N=C(N)N
InChIInChI=1S/C10H24N10/c11-7(12)19-9(15)17-5-3-1-2-4-6-18-10(16)20-8(13)14/h1-6H2,(H6,11,12,15,17,19)(H6,13,14,16,18,20)
InChIKeyRXGSAYBOEDPICZ-UHFFFAOYSA-N
XLogP-2.28
TPSA205.56 Ų
H-Bond Donors6
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms20
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500284.37
LogP ≤ 5-2.28
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-[6-[[amino-(diaminomethylideneamino)methylidene]amino]hexyl]-1-(diaminomethylidene)guanidine?
The IUPAC name of 2-[6-[[amino-(diaminomethylideneamino)methylidene]amino]hexyl]-1-(diaminomethylidene)guanidine (CID 516375) is 2-[6-[[amino-(diaminomethylideneamino)methylidene]amino]hexyl]-1-(diaminomethylidene)guanidine.
What is the SMILES notation for 2-[6-[[amino-(diaminomethylideneamino)methylidene]amino]hexyl]-1-(diaminomethylidene)guanidine?
The canonical SMILES for 2-[6-[[amino-(diaminomethylideneamino)methylidene]amino]hexyl]-1-(diaminomethylidene)guanidine is NC(N)=N/C(N)=N/CCCCCC/N=C(\N)N=C(N)N.
What is the InChIKey of 2-[6-[[amino-(diaminomethylideneamino)methylidene]amino]hexyl]-1-(diaminomethylidene)guanidine?
The InChIKey is RXGSAYBOEDPICZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H24N10/c11-7(12)19-9(15)17-5-3-1-2-4-6-18-10(16)20-8(13)14/h1-6H2,(H6,11,12,15,17,19)(H6,13,14,16,18,20).
What are the key properties of 2-[6-[[amino-(diaminomethylideneamino)methylidene]amino]hexyl]-1-(diaminomethylidene)guanidine?
2-[6-[[amino-(diaminomethylideneamino)methylidene]amino]hexyl]-1-(diaminomethylidene)guanidine has a molecular weight of 284.37 g/mol, XLogP of -2.28, 7 rotatable bonds, 6 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[6-[[amino-(diaminomethylideneamino)methylidene]amino]hexyl]-1-(diaminomethylidene)guanidine is sourced from PubChem (CID 516375), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).