1,6-dimethyl-4-methylidenediazinane;ethane

C9H20N2 — CID 142959927

IUPAC1,6-dimethyl-4-methylidenediazinane;ethane
SMILESC=C1CNN(C)C(C)C1.CC
InChIInChI=1S/C7H14N2.C2H6/c1-6-4-7(2)9(3)8-5-6;1-2/h7-8H,1,4-5H2,2-3H3;1-2H3
InChIKeyCAKJIDPGLWQIJE-UHFFFAOYSA-N
MW156.27 g/mol
LogP1.80
Rot. Bonds

About 1,6-dimethyl-4-methylidenediazinane;ethane

1,6-dimethyl-4-methylidenediazinane;ethane (PubChem CID 142959927) has the molecular formula C9H20N2 and a molecular weight of 156.27 g/mol. Its IUPAC name is 1,6-dimethyl-4-methylidenediazinane;ethane.

Molecular Properties

Compound Name1,6-dimethyl-4-methylidenediazinane;ethane
PubChem CID142959927
Molecular FormulaC9H20N2
Molecular Weight156.27 g/mol
Exact Mass156.16
IUPAC Name1,6-dimethyl-4-methylidenediazinane;ethane
SMILESC=C1CNN(C)C(C)C1.CC
InChIInChI=1S/C7H14N2.C2H6/c1-6-4-7(2)9(3)8-5-6;1-2/h7-8H,1,4-5H2,2-3H3;1-2H3
InChIKeyCAKJIDPGLWQIJE-UHFFFAOYSA-N
XLogP1.80
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.27
LogP ≤ 51.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1,6-dimethyl-4-methylidenediazinane;ethane?
The IUPAC name of 1,6-dimethyl-4-methylidenediazinane;ethane (CID 142959927) is 1,6-dimethyl-4-methylidenediazinane;ethane.
What is the SMILES notation for 1,6-dimethyl-4-methylidenediazinane;ethane?
The canonical SMILES for 1,6-dimethyl-4-methylidenediazinane;ethane is C=C1CNN(C)C(C)C1.CC.
What is the InChIKey of 1,6-dimethyl-4-methylidenediazinane;ethane?
The InChIKey is CAKJIDPGLWQIJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14N2.C2H6/c1-6-4-7(2)9(3)8-5-6;1-2/h7-8H,1,4-5H2,2-3H3;1-2H3.
What are the key properties of 1,6-dimethyl-4-methylidenediazinane;ethane?
1,6-dimethyl-4-methylidenediazinane;ethane has a molecular weight of 156.27 g/mol, XLogP of 1.80, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,6-dimethyl-4-methylidenediazinane;ethane is sourced from PubChem (CID 142959927), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).