zinc;[(Z)-1-cyclohexylprop-1-enyl]-(dimethylamino)azanide;2-methylpropane

C15H30N2Zn — CID 177442682

IUPACzinc;[(Z)-1-cyclohexylprop-1-enyl]-(dimethylamino)azanide;2-methylpropane
SMILESC/C=C(\[N-]N(C)C)C1CCCCC1.C[C-](C)C.[Zn+2]
InChIInChI=1S/C11H21N2.C4H9.Zn/c1-4-11(12-13(2)3)10-8-6-5-7-9-10;1-4(2)3;/h4,10H,5-9H2,1-3H3;1-3H3;/q2*-1;+2/b11-4-;;
InChIKeyVSVJTZCNOZKYTR-LTTFOTGMSA-N
MW303.81 g/mol
LogP4.94
Rot. Bonds3

About zinc;[(Z)-1-cyclohexylprop-1-enyl]-(dimethylamino)azanide;2-methylpropane

zinc;[(Z)-1-cyclohexylprop-1-enyl]-(dimethylamino)azanide;2-methylpropane (PubChem CID 177442682) has the molecular formula C15H30N2Zn and a molecular weight of 303.81 g/mol. Its IUPAC name is zinc;[(Z)-1-cyclohexylprop-1-enyl]-(dimethylamino)azanide;2-methylpropane.

Molecular Properties

Compound Namezinc;[(Z)-1-cyclohexylprop-1-enyl]-(dimethylamino)azanide;2-methylpropane
PubChem CID177442682
Molecular FormulaC15H30N2Zn
Molecular Weight303.81 g/mol
Exact Mass302.17
IUPAC Namezinc;[(Z)-1-cyclohexylprop-1-enyl]-(dimethylamino)azanide;2-methylpropane
SMILESC/C=C(\[N-]N(C)C)C1CCCCC1.C[C-](C)C.[Zn+2]
InChIInChI=1S/C11H21N2.C4H9.Zn/c1-4-11(12-13(2)3)10-8-6-5-7-9-10;1-4(2)3;/h4,10H,5-9H2,1-3H3;1-3H3;/q2*-1;+2/b11-4-;;
InChIKeyVSVJTZCNOZKYTR-LTTFOTGMSA-N
XLogP4.94
TPSA17.34 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.81
LogP ≤ 54.94
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,N-dimethyl-4-propylcyclohexen-1-amine
CID 20725738
(Z)-1-cyclohexyl-N,N-dimethylprop-1-en-1-amine
CID 135253837
(E)-1-cyclohexyl-N,N-dimethylbut-1-en-1-amine
CID 142383031
(E)-N,N-dimethyl-1-(4-methylcyclohexyl)but-1-en-1-amine
CID 142383052
3-ethyl-N,N-dimethylcyclohexen-1-amine
CID 156141012
N,N-dimethyl-1-(4-methylcyclohexyl)but-1-en-1-amine
CID 167020083
ZINC;butane;cyclohexen-1-yl(dimethylamino)azanide
CID 10706565
ZINC;butane;cyclohexen-1-yl(dimethylamino)azanide
CID 15969602
2-[(Z)-1-cyclohexylprop-1-enyl]-1,1-dimethylhydrazine
CID 101358662
(E)-N,N-dimethyl-1-(4-methylcyclohexyl)pent-1-en-1-amine
CID 142973919
ZINC;cyclohexen-1-yl(dimethylamino)azanide;2-methylpropane
CID 177408648

Frequently Asked Questions

What is the IUPAC name of zinc;[(Z)-1-cyclohexylprop-1-enyl]-(dimethylamino)azanide;2-methylpropane?
The IUPAC name of zinc;[(Z)-1-cyclohexylprop-1-enyl]-(dimethylamino)azanide;2-methylpropane (CID 177442682) is zinc;[(Z)-1-cyclohexylprop-1-enyl]-(dimethylamino)azanide;2-methylpropane.
What is the SMILES notation for zinc;[(Z)-1-cyclohexylprop-1-enyl]-(dimethylamino)azanide;2-methylpropane?
The canonical SMILES for zinc;[(Z)-1-cyclohexylprop-1-enyl]-(dimethylamino)azanide;2-methylpropane is C/C=C(\[N-]N(C)C)C1CCCCC1.C[C-](C)C.[Zn+2].
What is the InChIKey of zinc;[(Z)-1-cyclohexylprop-1-enyl]-(dimethylamino)azanide;2-methylpropane?
The InChIKey is VSVJTZCNOZKYTR-LTTFOTGMSA-N. The full InChI is InChI=1S/C11H21N2.C4H9.Zn/c1-4-11(12-13(2)3)10-8-6-5-7-9-10;1-4(2)3;/h4,10H,5-9H2,1-3H3;1-3H3;/q2*-1;+2/b11-4-;;.
What are the key properties of zinc;[(Z)-1-cyclohexylprop-1-enyl]-(dimethylamino)azanide;2-methylpropane?
zinc;[(Z)-1-cyclohexylprop-1-enyl]-(dimethylamino)azanide;2-methylpropane has a molecular weight of 303.81 g/mol, XLogP of 4.94, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for zinc;[(Z)-1-cyclohexylprop-1-enyl]-(dimethylamino)azanide;2-methylpropane is sourced from PubChem (CID 177442682), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).