copper(1+);[(Z)-1-(3,4-dihydro-2H-pyrrol-5-yl)prop-1-en-2-yl]azanide;trimethyl(propa-1,2-dienyl)silane

C13H23CuN2Si — CID 140863045

IUPACcopper(1+);[(Z)-1-(3,4-dihydro-2H-pyrrol-5-yl)prop-1-en-2-yl]azanide;trimethyl(propa-1,2-dienyl)silane
SMILESC/C([NH-])=C/C1=NCCC1.C=C=C[Si](C)(C)C.[Cu+]
InChIInChI=1S/C7H11N2.C6H12Si.Cu/c1-6(8)5-7-3-2-4-9-7;1-5-6-7(2,3)4;/h5,8H,2-4H2,1H3;6H,1H2,2-4H3;/q-1;;+1/b6-5-;;
InChIKeyTXPJCTBCZWJKJH-XNOMRPDFSA-N
MW298.97 g/mol
LogP4.38
Rot. Bonds2

About copper(1+);[(Z)-1-(3,4-dihydro-2H-pyrrol-5-yl)prop-1-en-2-yl]azanide;trimethyl(propa-1,2-dienyl)silane

copper(1+);[(Z)-1-(3,4-dihydro-2H-pyrrol-5-yl)prop-1-en-2-yl]azanide;trimethyl(propa-1,2-dienyl)silane (PubChem CID 140863045) has the molecular formula C13H23CuN2Si and a molecular weight of 298.97 g/mol. Its IUPAC name is copper(1+);[(Z)-1-(3,4-dihydro-2H-pyrrol-5-yl)prop-1-en-2-yl]azanide;trimethyl(propa-1,2-dienyl)silane.

Molecular Properties

Compound Namecopper(1+);[(Z)-1-(3,4-dihydro-2H-pyrrol-5-yl)prop-1-en-2-yl]azanide;trimethyl(propa-1,2-dienyl)silane
PubChem CID140863045
Molecular FormulaC13H23CuN2Si
Molecular Weight298.97 g/mol
Exact Mass298.09
IUPAC Namecopper(1+);[(Z)-1-(3,4-dihydro-2H-pyrrol-5-yl)prop-1-en-2-yl]azanide;trimethyl(propa-1,2-dienyl)silane
SMILESC/C([NH-])=C/C1=NCCC1.C=C=C[Si](C)(C)C.[Cu+]
InChIInChI=1S/C7H11N2.C6H12Si.Cu/c1-6(8)5-7-3-2-4-9-7;1-5-6-7(2,3)4;/h5,8H,2-4H2,1H3;6H,1H2,2-4H3;/q-1;;+1/b6-5-;;
InChIKeyTXPJCTBCZWJKJH-XNOMRPDFSA-N
XLogP4.38
TPSA36.16 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.97
LogP ≤ 54.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of copper(1+);[(Z)-1-(3,4-dihydro-2H-pyrrol-5-yl)prop-1-en-2-yl]azanide;trimethyl(propa-1,2-dienyl)silane?
The IUPAC name of copper(1+);[(Z)-1-(3,4-dihydro-2H-pyrrol-5-yl)prop-1-en-2-yl]azanide;trimethyl(propa-1,2-dienyl)silane (CID 140863045) is copper(1+);[(Z)-1-(3,4-dihydro-2H-pyrrol-5-yl)prop-1-en-2-yl]azanide;trimethyl(propa-1,2-dienyl)silane.
What is the SMILES notation for copper(1+);[(Z)-1-(3,4-dihydro-2H-pyrrol-5-yl)prop-1-en-2-yl]azanide;trimethyl(propa-1,2-dienyl)silane?
The canonical SMILES for copper(1+);[(Z)-1-(3,4-dihydro-2H-pyrrol-5-yl)prop-1-en-2-yl]azanide;trimethyl(propa-1,2-dienyl)silane is C/C([NH-])=C/C1=NCCC1.C=C=C[Si](C)(C)C.[Cu+].
What is the InChIKey of copper(1+);[(Z)-1-(3,4-dihydro-2H-pyrrol-5-yl)prop-1-en-2-yl]azanide;trimethyl(propa-1,2-dienyl)silane?
The InChIKey is TXPJCTBCZWJKJH-XNOMRPDFSA-N. The full InChI is InChI=1S/C7H11N2.C6H12Si.Cu/c1-6(8)5-7-3-2-4-9-7;1-5-6-7(2,3)4;/h5,8H,2-4H2,1H3;6H,1H2,2-4H3;/q-1;;+1/b6-5-;;.
What are the key properties of copper(1+);[(Z)-1-(3,4-dihydro-2H-pyrrol-5-yl)prop-1-en-2-yl]azanide;trimethyl(propa-1,2-dienyl)silane?
copper(1+);[(Z)-1-(3,4-dihydro-2H-pyrrol-5-yl)prop-1-en-2-yl]azanide;trimethyl(propa-1,2-dienyl)silane has a molecular weight of 298.97 g/mol, XLogP of 4.38, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for copper(1+);[(Z)-1-(3,4-dihydro-2H-pyrrol-5-yl)prop-1-en-2-yl]azanide;trimethyl(propa-1,2-dienyl)silane is sourced from PubChem (CID 140863045), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).