potassium;carbanide;ethane;1-prop-2-ynylpyrrolidine

C10H19KN- — CID 165120993

IUPACpotassium;carbanide;ethane;1-prop-2-ynylpyrrolidine
SMILESCC.[C-]#CCN1CCCC1.[CH3-].[K+]
InChIInChI=1S/C7H10N.C2H6.CH3.K/c1-2-5-8-6-3-4-7-8;1-2;;/h3-7H2;1-2H3;1H3;/q-1;;-1;+1
InChIKeyCDUUNCPAJRKLSB-UHFFFAOYSA-N
MW192.37 g/mol
LogP-0.85
Rot. Bonds1

About potassium;carbanide;ethane;1-prop-2-ynylpyrrolidine

potassium;carbanide;ethane;1-prop-2-ynylpyrrolidine (PubChem CID 165120993) has the molecular formula C10H19KN- and a molecular weight of 192.37 g/mol. Its IUPAC name is potassium;carbanide;ethane;1-prop-2-ynylpyrrolidine.

Molecular Properties

Compound Namepotassium;carbanide;ethane;1-prop-2-ynylpyrrolidine
PubChem CID165120993
Molecular FormulaC10H19KN-
Molecular Weight192.37 g/mol
Exact Mass192.12
IUPAC Namepotassium;carbanide;ethane;1-prop-2-ynylpyrrolidine
SMILESCC.[C-]#CCN1CCCC1.[CH3-].[K+]
InChIInChI=1S/C7H10N.C2H6.CH3.K/c1-2-5-8-6-3-4-7-8;1-2;;/h3-7H2;1-2H3;1H3;/q-1;;-1;+1
InChIKeyCDUUNCPAJRKLSB-UHFFFAOYSA-N
XLogP-0.85
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.37
LogP ≤ 5-0.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

1-Butylpyrrolidine
CID 69843
1-Butyl-1-methylpyrrolidinium chloride
CID 11769095
1-Methyl-1-propylpyrrolidinium iodide
CID 12059922
1-[6-(Diethylamino)-2-hexynyl]pyrrolidine
CID 96200
1-Butyl-1-methylpyrrolidinium bromide
CID 11009532
1-Methyl-1-propylpyrrolidinium chloride
CID 60196394
1-Butyl-1-methylpyrrolidinium iodide
CID 11076461
Pyrrolidinium, 1,1-diethyl-, bromide
CID 122438
1-Methyl-1-propylpyrrolidinium bromide
CID 16719897
1-Butyl-1-methylpyrrolidinium
CID 11009533
1-Ethyl-1-methylpyrrolidinium
CID 112265
1-Methyl-1-propylpyrrolidinium
CID 12059918

Frequently Asked Questions

What is the IUPAC name of potassium;carbanide;ethane;1-prop-2-ynylpyrrolidine?
The IUPAC name of potassium;carbanide;ethane;1-prop-2-ynylpyrrolidine (CID 165120993) is potassium;carbanide;ethane;1-prop-2-ynylpyrrolidine.
What is the SMILES notation for potassium;carbanide;ethane;1-prop-2-ynylpyrrolidine?
The canonical SMILES for potassium;carbanide;ethane;1-prop-2-ynylpyrrolidine is CC.[C-]#CCN1CCCC1.[CH3-].[K+].
What is the InChIKey of potassium;carbanide;ethane;1-prop-2-ynylpyrrolidine?
The InChIKey is CDUUNCPAJRKLSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10N.C2H6.CH3.K/c1-2-5-8-6-3-4-7-8;1-2;;/h3-7H2;1-2H3;1H3;/q-1;;-1;+1.
What are the key properties of potassium;carbanide;ethane;1-prop-2-ynylpyrrolidine?
potassium;carbanide;ethane;1-prop-2-ynylpyrrolidine has a molecular weight of 192.37 g/mol, XLogP of -0.85, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for potassium;carbanide;ethane;1-prop-2-ynylpyrrolidine is sourced from PubChem (CID 165120993), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).