(2E)-2-[(dimethylamino)methylimino]-N,N-dimethylethanamine

C7H17N3 — CID 20673994

IUPAC(2E)-2-[(dimethylamino)methylimino]-N,N-dimethylethanamine
SMILESCN(C)C/C=N/CN(C)C
InChIInChI=1S/C7H17N3/c1-9(2)6-5-8-7-10(3)4/h5H,6-7H2,1-4H3/b8-5+
InChIKeyYVGGVMMXPBNLAS-VMPITWQZSA-N
MW143.23 g/mol
LogP0.14
Rot. Bonds4

About (2E)-2-[(dimethylamino)methylimino]-N,N-dimethylethanamine

(2E)-2-[(dimethylamino)methylimino]-N,N-dimethylethanamine (PubChem CID 20673994) has the molecular formula C7H17N3 and a molecular weight of 143.23 g/mol. Its IUPAC name is (2E)-2-[(dimethylamino)methylimino]-N,N-dimethylethanamine.

Molecular Properties

Compound Name(2E)-2-[(dimethylamino)methylimino]-N,N-dimethylethanamine
PubChem CID20673994
Molecular FormulaC7H17N3
Molecular Weight143.23 g/mol
Exact Mass143.14
IUPAC Name(2E)-2-[(dimethylamino)methylimino]-N,N-dimethylethanamine
SMILESCN(C)C/C=N/CN(C)C
InChIInChI=1S/C7H17N3/c1-9(2)6-5-8-7-10(3)4/h5H,6-7H2,1-4H3/b8-5+
InChIKeyYVGGVMMXPBNLAS-VMPITWQZSA-N
XLogP0.14
TPSA18.84 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.23
LogP ≤ 50.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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 (2E)-2-[(dimethylamino)methylimino]-N,N-dimethylethanamine?
The IUPAC name of (2E)-2-[(dimethylamino)methylimino]-N,N-dimethylethanamine (CID 20673994) is (2E)-2-[(dimethylamino)methylimino]-N,N-dimethylethanamine.
What is the SMILES notation for (2E)-2-[(dimethylamino)methylimino]-N,N-dimethylethanamine?
The canonical SMILES for (2E)-2-[(dimethylamino)methylimino]-N,N-dimethylethanamine is CN(C)C/C=N/CN(C)C.
What is the InChIKey of (2E)-2-[(dimethylamino)methylimino]-N,N-dimethylethanamine?
The InChIKey is YVGGVMMXPBNLAS-VMPITWQZSA-N. The full InChI is InChI=1S/C7H17N3/c1-9(2)6-5-8-7-10(3)4/h5H,6-7H2,1-4H3/b8-5+.
What are the key properties of (2E)-2-[(dimethylamino)methylimino]-N,N-dimethylethanamine?
(2E)-2-[(dimethylamino)methylimino]-N,N-dimethylethanamine has a molecular weight of 143.23 g/mol, XLogP of 0.14, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2E)-2-[(dimethylamino)methylimino]-N,N-dimethylethanamine is sourced from PubChem (CID 20673994), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).