zinc;cyclohexen-1-yl(dimethylamino)azanide;2-methylpropane

C12H24N2Zn — CID 177408648

IUPACzinc;cyclohexen-1-yl(dimethylamino)azanide;2-methylpropane
SMILESCN(C)[N-]C1=CCCCC1.C[C-](C)C.[Zn+2]
InChIInChI=1S/C8H15N2.C4H9.Zn/c1-10(2)9-8-6-4-3-5-7-8;1-4(2)3;/h6H,3-5,7H2,1-2H3;1-3H3;/q2*-1;+2
InChIKeyWOLHAXYUEURGRR-UHFFFAOYSA-N
MW261.73 g/mol
LogP3.91
Rot. Bonds2

About zinc;cyclohexen-1-yl(dimethylamino)azanide;2-methylpropane

zinc;cyclohexen-1-yl(dimethylamino)azanide;2-methylpropane (PubChem CID 177408648) has the molecular formula C12H24N2Zn and a molecular weight of 261.73 g/mol. Its IUPAC name is zinc;cyclohexen-1-yl(dimethylamino)azanide;2-methylpropane.

Molecular Properties

Compound Namezinc;cyclohexen-1-yl(dimethylamino)azanide;2-methylpropane
PubChem CID177408648
Molecular FormulaC12H24N2Zn
Molecular Weight261.73 g/mol
Exact Mass260.12
IUPAC Namezinc;cyclohexen-1-yl(dimethylamino)azanide;2-methylpropane
SMILESCN(C)[N-]C1=CCCCC1.C[C-](C)C.[Zn+2]
InChIInChI=1S/C8H15N2.C4H9.Zn/c1-10(2)9-8-6-4-3-5-7-8;1-4(2)3;/h6H,3-5,7H2,1-2H3;1-3H3;/q2*-1;+2
InChIKeyWOLHAXYUEURGRR-UHFFFAOYSA-N
XLogP3.91
TPSA17.34 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.73
LogP ≤ 53.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

Lithium dimethylamino-(6-methylcyclohexen-1-yl)azanide
CID 15122495
N-(cyclohexen-1-yldiazenyl)-N-methylpropan-2-amine
CID 118609539
N-(cyclohexen-1-yldiazenyl)-N-propan-2-ylpropan-2-amine
CID 118609548
ZINC;butane;cyclohexen-1-yl(dimethylamino)azanide
CID 10706565
ZINC;butane;cyclohexen-1-yl(dimethylamino)azanide
CID 15969602
zinc;[(Z)-1-cyclohexylprop-1-enyl]-(dimethylamino)azanide;2-methylpropane
CID 177442682
ZINC;cyclohepten-1-yl(dimethylamino)azanide;2-methylpropane
CID 177486830
zinc;[(1E)-cycloocten-1-yl]-(dimethylamino)azanide;2-methylpropane
CID 177509267
zinc;dimethylamino-[(E)-2-methylhept-3-en-3-yl]azanide;2-methylpropane
CID 177515069
zinc;dimethylamino-[(E)-pent-2-en-3-yl]azanide;2-methylpropane
CID 177606481

Frequently Asked Questions

What is the IUPAC name of zinc;cyclohexen-1-yl(dimethylamino)azanide;2-methylpropane?
The IUPAC name of zinc;cyclohexen-1-yl(dimethylamino)azanide;2-methylpropane (CID 177408648) is zinc;cyclohexen-1-yl(dimethylamino)azanide;2-methylpropane.
What is the SMILES notation for zinc;cyclohexen-1-yl(dimethylamino)azanide;2-methylpropane?
The canonical SMILES for zinc;cyclohexen-1-yl(dimethylamino)azanide;2-methylpropane is CN(C)[N-]C1=CCCCC1.C[C-](C)C.[Zn+2].
What is the InChIKey of zinc;cyclohexen-1-yl(dimethylamino)azanide;2-methylpropane?
The InChIKey is WOLHAXYUEURGRR-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15N2.C4H9.Zn/c1-10(2)9-8-6-4-3-5-7-8;1-4(2)3;/h6H,3-5,7H2,1-2H3;1-3H3;/q2*-1;+2.
What are the key properties of zinc;cyclohexen-1-yl(dimethylamino)azanide;2-methylpropane?
zinc;cyclohexen-1-yl(dimethylamino)azanide;2-methylpropane has a molecular weight of 261.73 g/mol, XLogP of 3.91, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for zinc;cyclohexen-1-yl(dimethylamino)azanide;2-methylpropane is sourced from PubChem (CID 177408648), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).