potassium [(6Z)-6-butylidenecyclohexa-2,4-dien-1-ylidene]azanide

C10H12KN — CID 156874481

IUPACpotassium [(6Z)-6-butylidenecyclohexa-2,4-dien-1-ylidene]azanide
SMILESCCC/C=C1/C=CC=CC1=[N-].[K+]
InChIInChI=1S/C10H12N.K/c1-2-3-6-9-7-4-5-8-10(9)11;/h4-8H,2-3H2,1H3;/q-1;+1/b9-6-;
InChIKeyCBWRVZGTNXAEHV-BORNJIKYSA-N
MW185.31 g/mol
LogP-0.15
Rot. Bonds2

About potassium [(6Z)-6-butylidenecyclohexa-2,4-dien-1-ylidene]azanide

potassium [(6Z)-6-butylidenecyclohexa-2,4-dien-1-ylidene]azanide (PubChem CID 156874481) has the molecular formula C10H12KN and a molecular weight of 185.31 g/mol. Its IUPAC name is potassium [(6Z)-6-butylidenecyclohexa-2,4-dien-1-ylidene]azanide.

Molecular Properties

Compound Namepotassium [(6Z)-6-butylidenecyclohexa-2,4-dien-1-ylidene]azanide
PubChem CID156874481
Molecular FormulaC10H12KN
Molecular Weight185.31 g/mol
Exact Mass185.06
IUPAC Namepotassium [(6Z)-6-butylidenecyclohexa-2,4-dien-1-ylidene]azanide
SMILESCCC/C=C1/C=CC=CC1=[N-].[K+]
InChIInChI=1S/C10H12N.K/c1-2-3-6-9-7-4-5-8-10(9)11;/h4-8H,2-3H2,1H3;/q-1;+1/b9-6-;
InChIKeyCBWRVZGTNXAEHV-BORNJIKYSA-N
XLogP-0.15
TPSA22.30 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.31
LogP ≤ 5-0.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of potassium [(6Z)-6-butylidenecyclohexa-2,4-dien-1-ylidene]azanide?
The IUPAC name of potassium [(6Z)-6-butylidenecyclohexa-2,4-dien-1-ylidene]azanide (CID 156874481) is potassium [(6Z)-6-butylidenecyclohexa-2,4-dien-1-ylidene]azanide.
What is the SMILES notation for potassium [(6Z)-6-butylidenecyclohexa-2,4-dien-1-ylidene]azanide?
The canonical SMILES for potassium [(6Z)-6-butylidenecyclohexa-2,4-dien-1-ylidene]azanide is CCC/C=C1/C=CC=CC1=[N-].[K+].
What is the InChIKey of potassium [(6Z)-6-butylidenecyclohexa-2,4-dien-1-ylidene]azanide?
The InChIKey is CBWRVZGTNXAEHV-BORNJIKYSA-N. The full InChI is InChI=1S/C10H12N.K/c1-2-3-6-9-7-4-5-8-10(9)11;/h4-8H,2-3H2,1H3;/q-1;+1/b9-6-;.
What are the key properties of potassium [(6Z)-6-butylidenecyclohexa-2,4-dien-1-ylidene]azanide?
potassium [(6Z)-6-butylidenecyclohexa-2,4-dien-1-ylidene]azanide has a molecular weight of 185.31 g/mol, XLogP of -0.15, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for potassium [(6Z)-6-butylidenecyclohexa-2,4-dien-1-ylidene]azanide is sourced from PubChem (CID 156874481), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).