1-N,1-N'-dimethanidyl-1-N,1-N'-dimethylethene-1,1-diamine

C6H12N2-2 — CID 58869977

IUPAC1-N,1-N'-dimethanidyl-1-N,1-N'-dimethylethene-1,1-diamine
SMILESC=C(N([CH2-])C)N([CH2-])C
InChIInChI=1S/C6H12N2/c1-6(7(2)3)8(4)5/h1-2,4H2,3,5H3/q-2
InChIKeyYTYIINLIYAQNAD-UHFFFAOYSA-N
MW112.18 g/mol
LogP0.90
Rot. Bonds2

About 1-N,1-N'-dimethanidyl-1-N,1-N'-dimethylethene-1,1-diamine

1-N,1-N'-dimethanidyl-1-N,1-N'-dimethylethene-1,1-diamine (PubChem CID 58869977) has the molecular formula C6H12N2-2 and a molecular weight of 112.18 g/mol. Its IUPAC name is 1-N,1-N'-dimethanidyl-1-N,1-N'-dimethylethene-1,1-diamine.

Molecular Properties

Compound Name1-N,1-N'-dimethanidyl-1-N,1-N'-dimethylethene-1,1-diamine
PubChem CID58869977
Molecular FormulaC6H12N2-2
Molecular Weight112.18 g/mol
Exact Mass112.10
IUPAC Name1-N,1-N'-dimethanidyl-1-N,1-N'-dimethylethene-1,1-diamine
SMILESC=C(N([CH2-])C)N([CH2-])C
InChIInChI=1S/C6H12N2/c1-6(7(2)3)8(4)5/h1-2,4H2,3,5H3/q-2
InChIKeyYTYIINLIYAQNAD-UHFFFAOYSA-N
XLogP0.90
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500112.18
LogP ≤ 50.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-N,1-N'-dimethanidyl-1-N,1-N'-dimethylethene-1,1-diamine?
The IUPAC name of 1-N,1-N'-dimethanidyl-1-N,1-N'-dimethylethene-1,1-diamine (CID 58869977) is 1-N,1-N'-dimethanidyl-1-N,1-N'-dimethylethene-1,1-diamine.
What is the SMILES notation for 1-N,1-N'-dimethanidyl-1-N,1-N'-dimethylethene-1,1-diamine?
The canonical SMILES for 1-N,1-N'-dimethanidyl-1-N,1-N'-dimethylethene-1,1-diamine is C=C(N([CH2-])C)N([CH2-])C.
What is the InChIKey of 1-N,1-N'-dimethanidyl-1-N,1-N'-dimethylethene-1,1-diamine?
The InChIKey is YTYIINLIYAQNAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12N2/c1-6(7(2)3)8(4)5/h1-2,4H2,3,5H3/q-2.
What are the key properties of 1-N,1-N'-dimethanidyl-1-N,1-N'-dimethylethene-1,1-diamine?
1-N,1-N'-dimethanidyl-1-N,1-N'-dimethylethene-1,1-diamine has a molecular weight of 112.18 g/mol, XLogP of 0.90, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N,1-N'-dimethanidyl-1-N,1-N'-dimethylethene-1,1-diamine is sourced from PubChem (CID 58869977), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).