potassium butylazanide

C4H9KN- — CID 59104509

IUPACpotassium butylazanide
SMILESCC[CH-]C[NH-].[K+]
InChIInChI=1S/C4H9N.K/c1-2-3-4-5;/h3,5H,2,4H2,1H3;/q-2;+1
InChIKeyYUVNBBJRFKTQLE-UHFFFAOYSA-N
MW110.22 g/mol
LogP-1.34
Rot. Bonds2

About potassium butylazanide

potassium butylazanide (PubChem CID 59104509) has the molecular formula C4H9KN- and a molecular weight of 110.22 g/mol. Its IUPAC name is potassium butylazanide.

Molecular Properties

Compound Namepotassium butylazanide
PubChem CID59104509
Molecular FormulaC4H9KN-
Molecular Weight110.22 g/mol
Exact Mass110.04
IUPAC Namepotassium butylazanide
SMILESCC[CH-]C[NH-].[K+]
InChIInChI=1S/C4H9N.K/c1-2-3-4-5;/h3,5H,2,4H2,1H3;/q-2;+1
InChIKeyYUVNBBJRFKTQLE-UHFFFAOYSA-N
XLogP-1.34
TPSA23.80 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500110.22
LogP ≤ 5-1.34
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

ethylazanide;methylazanide;tungsten(2+)
CID 59615066
azanide;pentane;tetrakis(yttrium)
CID 59557790
bromozinc(1+);pentane
CID 4146247
ethane;pentane;technetium
CID 59000401
hexane
CID 90853474
potassium;butane;hydrate
CID 172820423
ethylazanide;pentakis(yttrium)
CID 59645440
ethylazanide;hafnium
CID 140538312
1-butoxybutane;tris(vanadium)
CID 162037301
potassium hexylazanide
CID 139799691
heptane;zinc;hydrobromide
CID 87905208
americium;hexane
CID 163761103

Frequently Asked Questions

What is the IUPAC name of potassium butylazanide?
The IUPAC name of potassium butylazanide (CID 59104509) is potassium butylazanide.
What is the SMILES notation for potassium butylazanide?
The canonical SMILES for potassium butylazanide is CC[CH-]C[NH-].[K+].
What is the InChIKey of potassium butylazanide?
The InChIKey is YUVNBBJRFKTQLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H9N.K/c1-2-3-4-5;/h3,5H,2,4H2,1H3;/q-2;+1.
What are the key properties of potassium butylazanide?
potassium butylazanide has a molecular weight of 110.22 g/mol, XLogP of -1.34, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for potassium butylazanide is sourced from PubChem (CID 59104509), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).