N-(5-methylhex-1-en-2-yl)methanimine;tungsten(2+)

C8H13NW — CID 58767682

IUPACN-(5-methylhex-1-en-2-yl)methanimine;tungsten(2+)
SMILES[H]/[C-]=N/C(=[C-]/[H])CCC(C)C.[W+2]
InChIInChI=1S/C8H13N.W/c1-7(2)5-6-8(3)9-4;/h3-4,7H,5-6H2,1-2H3;/q-2;+2
InChIKeyOYORDDIQRYXRPJ-UHFFFAOYSA-N
MW307.04 g/mol
LogP2.31
Rot. Bonds4

About N-(5-methylhex-1-en-2-yl)methanimine;tungsten(2+)

N-(5-methylhex-1-en-2-yl)methanimine;tungsten(2+) (PubChem CID 58767682) has the molecular formula C8H13NW and a molecular weight of 307.04 g/mol. Its IUPAC name is N-(5-methylhex-1-en-2-yl)methanimine;tungsten(2+).

Molecular Properties

Compound NameN-(5-methylhex-1-en-2-yl)methanimine;tungsten(2+)
PubChem CID58767682
Molecular FormulaC8H13NW
Molecular Weight307.04 g/mol
Exact Mass307.06
IUPAC NameN-(5-methylhex-1-en-2-yl)methanimine;tungsten(2+)
SMILES[H]/[C-]=N/C(=[C-]/[H])CCC(C)C.[W+2]
InChIInChI=1S/C8H13N.W/c1-7(2)5-6-8(3)9-4;/h3-4,7H,5-6H2,1-2H3;/q-2;+2
InChIKeyOYORDDIQRYXRPJ-UHFFFAOYSA-N
XLogP2.31
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.04
LogP ≤ 52.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-(5-methylhex-1-en-2-yl)methanimine;tungsten(2+)?
The IUPAC name of N-(5-methylhex-1-en-2-yl)methanimine;tungsten(2+) (CID 58767682) is N-(5-methylhex-1-en-2-yl)methanimine;tungsten(2+).
What is the SMILES notation for N-(5-methylhex-1-en-2-yl)methanimine;tungsten(2+)?
The canonical SMILES for N-(5-methylhex-1-en-2-yl)methanimine;tungsten(2+) is [H]/[C-]=N/C(=[C-]/[H])CCC(C)C.[W+2].
What is the InChIKey of N-(5-methylhex-1-en-2-yl)methanimine;tungsten(2+)?
The InChIKey is OYORDDIQRYXRPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13N.W/c1-7(2)5-6-8(3)9-4;/h3-4,7H,5-6H2,1-2H3;/q-2;+2.
What are the key properties of N-(5-methylhex-1-en-2-yl)methanimine;tungsten(2+)?
N-(5-methylhex-1-en-2-yl)methanimine;tungsten(2+) has a molecular weight of 307.04 g/mol, XLogP of 2.31, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-methylhex-1-en-2-yl)methanimine;tungsten(2+) is sourced from PubChem (CID 58767682), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).