dimethyl-bis(prop-2-enyl)azanium;polane;chloride

C8H18ClNPo — CID 173045035

IUPACdimethyl-bis(prop-2-enyl)azanium;polane;chloride
SMILESC=CC[N+](C)(C)CC=C.[Cl-].[PoH2]
InChIInChI=1S/C8H16N.ClH.Po.2H/c1-5-7-9(3,4)8-6-2;;;;/h5-6H,1-2,7-8H2,3-4H3;1H;;;/q+1;;;;/p-1
InChIKeyATDQLYXWFCSJLH-UHFFFAOYSA-M
MW372.69 g/mol
LogP-2.48
Rot. Bonds4

About dimethyl-bis(prop-2-enyl)azanium;polane;chloride

dimethyl-bis(prop-2-enyl)azanium;polane;chloride (PubChem CID 173045035) has the molecular formula C8H18ClNPo and a molecular weight of 372.69 g/mol. Its IUPAC name is dimethyl-bis(prop-2-enyl)azanium;polane;chloride.

Molecular Properties

Compound Namedimethyl-bis(prop-2-enyl)azanium;polane;chloride
PubChem CID173045035
Molecular FormulaC8H18ClNPo
Molecular Weight372.69 g/mol
Exact Mass372.10
IUPAC Namedimethyl-bis(prop-2-enyl)azanium;polane;chloride
SMILESC=CC[N+](C)(C)CC=C.[Cl-].[PoH2]
InChIInChI=1S/C8H16N.ClH.Po.2H/c1-5-7-9(3,4)8-6-2;;;;/h5-6H,1-2,7-8H2,3-4H3;1H;;;/q+1;;;;/p-1
InChIKeyATDQLYXWFCSJLH-UHFFFAOYSA-M
XLogP-2.48
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.69
LogP ≤ 5-2.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_2', 'substructure': 'N/A'}

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Related Compounds

dimethyl-bis(prop-2-enyl)azanium;chloride;hydrate
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dimethyl-bis(prop-2-enyl)azanium;prop-2-en-1-amine;chloride
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dimethyl-bis(prop-2-enyl)azanium nitrate
CID 19988438
but-1-ene;ethyl-dimethyl-prop-2-enylazanium;chloride
CID 174921131
dimethyl-bis(prop-2-enyl)azanium;prop-2-enenitrile;prop-2-ene-1-thiol;chloride
CID 175156834
methyl-tris(prop-2-enyl)azanium;chloride;hydrate
CID 139647541
dimethyl-bis(prop-2-enyl)azanium;2,2-dimethylpropanoic acid
CID 87375261
[(E)-hex-2-enyl]-dimethyl-prop-2-enylazanium
CID 153427948
methyl-tris(prop-2-enyl)azanium iodide
CID 14172654
trimethyl(prop-2-enyl)azanium;dihydrochloride
CID 174494481
butyl-dimethyl-prop-2-enylazanium iodide
CID 171383086
azane;decyl-dimethyl-prop-2-enylazanium;chloride;hydrochloride
CID 174658869

Frequently Asked Questions

What is the IUPAC name of dimethyl-bis(prop-2-enyl)azanium;polane;chloride?
The IUPAC name of dimethyl-bis(prop-2-enyl)azanium;polane;chloride (CID 173045035) is dimethyl-bis(prop-2-enyl)azanium;polane;chloride.
What is the SMILES notation for dimethyl-bis(prop-2-enyl)azanium;polane;chloride?
The canonical SMILES for dimethyl-bis(prop-2-enyl)azanium;polane;chloride is C=CC[N+](C)(C)CC=C.[Cl-].[PoH2].
What is the InChIKey of dimethyl-bis(prop-2-enyl)azanium;polane;chloride?
The InChIKey is ATDQLYXWFCSJLH-UHFFFAOYSA-M. The full InChI is InChI=1S/C8H16N.ClH.Po.2H/c1-5-7-9(3,4)8-6-2;;;;/h5-6H,1-2,7-8H2,3-4H3;1H;;;/q+1;;;;/p-1.
What are the key properties of dimethyl-bis(prop-2-enyl)azanium;polane;chloride?
dimethyl-bis(prop-2-enyl)azanium;polane;chloride has a molecular weight of 372.69 g/mol, XLogP of -2.48, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for dimethyl-bis(prop-2-enyl)azanium;polane;chloride is sourced from PubChem (CID 173045035), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).