zinc;butane;cyclohexen-1-yl(dimethylamino)azanide

C12H24N2Zn — CID 10706565

IUPACzinc;butane;cyclohexen-1-yl(dimethylamino)azanide
SMILESCN(C)[N-]C1=CCCCC1.[CH2-]CCC.[Zn+2]
InChIInChI=1S/C8H15N2.C4H9.Zn/c1-10(2)9-8-6-4-3-5-7-8;1-3-4-2;/h6H,3-5,7H2,1-2H3;1,3-4H2,2H3;/q2*-1;+2
InChIKeyHNZMFMLCEFVNNK-UHFFFAOYSA-N
MW261.73 g/mol
LogP3.91
Rot. Bonds3

About zinc;butane;cyclohexen-1-yl(dimethylamino)azanide

zinc;butane;cyclohexen-1-yl(dimethylamino)azanide (PubChem CID 10706565) has the molecular formula C12H24N2Zn and a molecular weight of 261.73 g/mol. Its IUPAC name is zinc;butane;cyclohexen-1-yl(dimethylamino)azanide.

Molecular Properties

Compound Namezinc;butane;cyclohexen-1-yl(dimethylamino)azanide
PubChem CID10706565
Molecular FormulaC12H24N2Zn
Molecular Weight261.73 g/mol
Exact Mass260.12
IUPAC Namezinc;butane;cyclohexen-1-yl(dimethylamino)azanide
SMILESCN(C)[N-]C1=CCCCC1.[CH2-]CCC.[Zn+2]
InChIInChI=1S/C8H15N2.C4H9.Zn/c1-10(2)9-8-6-4-3-5-7-8;1-3-4-2;/h6H,3-5,7H2,1-2H3;1,3-4H2,2H3;/q2*-1;+2
InChIKeyHNZMFMLCEFVNNK-UHFFFAOYSA-N
XLogP3.91
TPSA17.34 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
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

N,N-dimethylcyclohexene-1-carboxamide
CID 11019067
1-butylcyclononene
CID 56981158
1-(cyclohepten-1-yl)cycloheptene;trichloro(ethyl)silane
CID 67277470
1-(cyclodecen-1-yl)cyclodecene
CID 54296371
(1E)-1-[(1E)-cyclopentadecen-1-yl]cyclopentadecene
CID 139760940
2-(cyclohepten-1-yl)-2-fluorobutan-1-amine
CID 106655044
1-octylcyclohexene
CID 519088
1-pentylcyclododecene
CID 150654776
chloro-ethyl-dimethylsilane;1-(cyclohepten-1-yl)cycloheptene
CID 66646162
1-(cyclopenten-1-yl)cyclooctene
CID 91463872
cyclohexenylsilane
CID 23102944
1-(cyclohexen-1-yl)butan-1-amine
CID 62079375

Frequently Asked Questions

What is the IUPAC name of zinc;butane;cyclohexen-1-yl(dimethylamino)azanide?
The IUPAC name of zinc;butane;cyclohexen-1-yl(dimethylamino)azanide (CID 10706565) is zinc;butane;cyclohexen-1-yl(dimethylamino)azanide.
What is the SMILES notation for zinc;butane;cyclohexen-1-yl(dimethylamino)azanide?
The canonical SMILES for zinc;butane;cyclohexen-1-yl(dimethylamino)azanide is CN(C)[N-]C1=CCCCC1.[CH2-]CCC.[Zn+2].
What is the InChIKey of zinc;butane;cyclohexen-1-yl(dimethylamino)azanide?
The InChIKey is HNZMFMLCEFVNNK-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15N2.C4H9.Zn/c1-10(2)9-8-6-4-3-5-7-8;1-3-4-2;/h6H,3-5,7H2,1-2H3;1,3-4H2,2H3;/q2*-1;+2.
What are the key properties of zinc;butane;cyclohexen-1-yl(dimethylamino)azanide?
zinc;butane;cyclohexen-1-yl(dimethylamino)azanide has a molecular weight of 261.73 g/mol, XLogP of 3.91, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for zinc;butane;cyclohexen-1-yl(dimethylamino)azanide is sourced from PubChem (CID 10706565), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).