2-N,4-N,1,3-tetramethyl-1,3-diazetidine-2,4-diimine

C6H12N4 — CID 18740086

IUPAC2-N,4-N,1,3-tetramethyl-1,3-diazetidine-2,4-diimine
SMILESCN=C1N(C)C(=NC)N1C
InChIInChI=1S/C6H12N4/c1-7-5-9(3)6(8-2)10(5)4/h1-4H3/b7-5-,8-6+
InChIKeyWPBMBHJUUSYIKL-CGXWXWIYSA-N
MW140.19 g/mol
LogP-0.16
Rot. Bonds

About 2-N,4-N,1,3-tetramethyl-1,3-diazetidine-2,4-diimine

2-N,4-N,1,3-tetramethyl-1,3-diazetidine-2,4-diimine (PubChem CID 18740086) has the molecular formula C6H12N4 and a molecular weight of 140.19 g/mol. Its IUPAC name is 2-N,4-N,1,3-tetramethyl-1,3-diazetidine-2,4-diimine.

Molecular Properties

Compound Name2-N,4-N,1,3-tetramethyl-1,3-diazetidine-2,4-diimine
PubChem CID18740086
Molecular FormulaC6H12N4
Molecular Weight140.19 g/mol
Exact Mass140.11
IUPAC Name2-N,4-N,1,3-tetramethyl-1,3-diazetidine-2,4-diimine
SMILESCN=C1N(C)C(=NC)N1C
InChIInChI=1S/C6H12N4/c1-7-5-9(3)6(8-2)10(5)4/h1-4H3/b7-5-,8-6+
InChIKeyWPBMBHJUUSYIKL-CGXWXWIYSA-N
XLogP-0.16
TPSA31.20 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.19
LogP ≤ 5-0.16
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 2-N,4-N,1,3-tetramethyl-1,3-diazetidine-2,4-diimine?
The IUPAC name of 2-N,4-N,1,3-tetramethyl-1,3-diazetidine-2,4-diimine (CID 18740086) is 2-N,4-N,1,3-tetramethyl-1,3-diazetidine-2,4-diimine.
What is the SMILES notation for 2-N,4-N,1,3-tetramethyl-1,3-diazetidine-2,4-diimine?
The canonical SMILES for 2-N,4-N,1,3-tetramethyl-1,3-diazetidine-2,4-diimine is CN=C1N(C)C(=NC)N1C.
What is the InChIKey of 2-N,4-N,1,3-tetramethyl-1,3-diazetidine-2,4-diimine?
The InChIKey is WPBMBHJUUSYIKL-CGXWXWIYSA-N. The full InChI is InChI=1S/C6H12N4/c1-7-5-9(3)6(8-2)10(5)4/h1-4H3/b7-5-,8-6+.
What are the key properties of 2-N,4-N,1,3-tetramethyl-1,3-diazetidine-2,4-diimine?
2-N,4-N,1,3-tetramethyl-1,3-diazetidine-2,4-diimine has a molecular weight of 140.19 g/mol, XLogP of -0.16, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N,4-N,1,3-tetramethyl-1,3-diazetidine-2,4-diimine is sourced from PubChem (CID 18740086), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).