ethane;(Z)-2-N-methyl-4-N-methylidenepent-3-ene-2,4-diimine

C11H24N2 — CID 144528051

IUPACethane;(Z)-2-N-methyl-4-N-methylidenepent-3-ene-2,4-diimine
SMILESC=N/C(C)=C\C(C)=N\C.CC.CC
InChIInChI=1S/C7H12N2.2C2H6/c1-6(8-3)5-7(2)9-4;2*1-2/h5H,3H2,1-2,4H3;2*1-2H3/b6-5-,9-7+;;
InChIKeyGMULVHRNBUFEEV-MDFLZTAESA-N
MW184.33 g/mol
LogP3.73
Rot. Bonds2

About ethane;(Z)-2-N-methyl-4-N-methylidenepent-3-ene-2,4-diimine

ethane;(Z)-2-N-methyl-4-N-methylidenepent-3-ene-2,4-diimine (PubChem CID 144528051) has the molecular formula C11H24N2 and a molecular weight of 184.33 g/mol. Its IUPAC name is ethane;(Z)-2-N-methyl-4-N-methylidenepent-3-ene-2,4-diimine.

Molecular Properties

Compound Nameethane;(Z)-2-N-methyl-4-N-methylidenepent-3-ene-2,4-diimine
PubChem CID144528051
Molecular FormulaC11H24N2
Molecular Weight184.33 g/mol
Exact Mass184.19
IUPAC Nameethane;(Z)-2-N-methyl-4-N-methylidenepent-3-ene-2,4-diimine
SMILESC=N/C(C)=C\C(C)=N\C.CC.CC
InChIInChI=1S/C7H12N2.2C2H6/c1-6(8-3)5-7(2)9-4;2*1-2/h5H,3H2,1-2,4H3;2*1-2H3/b6-5-,9-7+;;
InChIKeyGMULVHRNBUFEEV-MDFLZTAESA-N
XLogP3.73
TPSA24.72 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.33
LogP ≤ 53.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of ethane;(Z)-2-N-methyl-4-N-methylidenepent-3-ene-2,4-diimine?
The IUPAC name of ethane;(Z)-2-N-methyl-4-N-methylidenepent-3-ene-2,4-diimine (CID 144528051) is ethane;(Z)-2-N-methyl-4-N-methylidenepent-3-ene-2,4-diimine.
What is the SMILES notation for ethane;(Z)-2-N-methyl-4-N-methylidenepent-3-ene-2,4-diimine?
The canonical SMILES for ethane;(Z)-2-N-methyl-4-N-methylidenepent-3-ene-2,4-diimine is C=N/C(C)=C\C(C)=N\C.CC.CC.
What is the InChIKey of ethane;(Z)-2-N-methyl-4-N-methylidenepent-3-ene-2,4-diimine?
The InChIKey is GMULVHRNBUFEEV-MDFLZTAESA-N. The full InChI is InChI=1S/C7H12N2.2C2H6/c1-6(8-3)5-7(2)9-4;2*1-2/h5H,3H2,1-2,4H3;2*1-2H3/b6-5-,9-7+;;.
What are the key properties of ethane;(Z)-2-N-methyl-4-N-methylidenepent-3-ene-2,4-diimine?
ethane;(Z)-2-N-methyl-4-N-methylidenepent-3-ene-2,4-diimine has a molecular weight of 184.33 g/mol, XLogP of 3.73, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;(Z)-2-N-methyl-4-N-methylidenepent-3-ene-2,4-diimine is sourced from PubChem (CID 144528051), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).