potassium (2Z)-N-methylpenta-2,4-dien-1-imine

C6H8KN — CID 156851839

IUPACpotassium (2Z)-N-methylpenta-2,4-dien-1-imine
SMILESC=C/C=C\[C-]=N\C.[K+]
InChIInChI=1S/C6H8N.K/c1-3-4-5-6-7-2;/h3-5H,1H2,2H3;/q-1;+1/b5-4-;
InChIKeyNNAFLLPSTBSUSQ-MKWAYWHRSA-N
MW133.23 g/mol
LogP-1.69
Rot. Bonds2

About potassium (2Z)-N-methylpenta-2,4-dien-1-imine

potassium (2Z)-N-methylpenta-2,4-dien-1-imine (PubChem CID 156851839) has the molecular formula C6H8KN and a molecular weight of 133.23 g/mol. Its IUPAC name is potassium (2Z)-N-methylpenta-2,4-dien-1-imine.

Molecular Properties

Compound Namepotassium (2Z)-N-methylpenta-2,4-dien-1-imine
PubChem CID156851839
Molecular FormulaC6H8KN
Molecular Weight133.23 g/mol
Exact Mass133.03
IUPAC Namepotassium (2Z)-N-methylpenta-2,4-dien-1-imine
SMILESC=C/C=C\[C-]=N\C.[K+]
InChIInChI=1S/C6H8N.K/c1-3-4-5-6-7-2;/h3-5H,1H2,2H3;/q-1;+1/b5-4-;
InChIKeyNNAFLLPSTBSUSQ-MKWAYWHRSA-N
XLogP-1.69
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500133.23
LogP ≤ 5-1.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'polyene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of potassium (2Z)-N-methylpenta-2,4-dien-1-imine?
The IUPAC name of potassium (2Z)-N-methylpenta-2,4-dien-1-imine (CID 156851839) is potassium (2Z)-N-methylpenta-2,4-dien-1-imine.
What is the SMILES notation for potassium (2Z)-N-methylpenta-2,4-dien-1-imine?
The canonical SMILES for potassium (2Z)-N-methylpenta-2,4-dien-1-imine is C=C/C=C\[C-]=N\C.[K+].
What is the InChIKey of potassium (2Z)-N-methylpenta-2,4-dien-1-imine?
The InChIKey is NNAFLLPSTBSUSQ-MKWAYWHRSA-N. The full InChI is InChI=1S/C6H8N.K/c1-3-4-5-6-7-2;/h3-5H,1H2,2H3;/q-1;+1/b5-4-;.
What are the key properties of potassium (2Z)-N-methylpenta-2,4-dien-1-imine?
potassium (2Z)-N-methylpenta-2,4-dien-1-imine has a molecular weight of 133.23 g/mol, XLogP of -1.69, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for potassium (2Z)-N-methylpenta-2,4-dien-1-imine is sourced from PubChem (CID 156851839), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).