ethyl-(1,2,3,5-tetramethylpyrazolidin-4-yl)diazene

C9H20N4 — CID 20644327

IUPACethyl-(1,2,3,5-tetramethylpyrazolidin-4-yl)diazene
SMILESCC/N=N/C1C(C)N(C)N(C)C1C
InChIInChI=1S/C9H20N4/c1-6-10-11-9-7(2)12(4)13(5)8(9)3/h7-9H,6H2,1-5H3/b11-10+
InChIKeyVINKYPNHTTWBRB-ZHACJKMWSA-N
MW184.29 g/mol
LogP1.40
Rot. Bonds2

About ethyl-(1,2,3,5-tetramethylpyrazolidin-4-yl)diazene

ethyl-(1,2,3,5-tetramethylpyrazolidin-4-yl)diazene (PubChem CID 20644327) has the molecular formula C9H20N4 and a molecular weight of 184.29 g/mol. Its IUPAC name is ethyl-(1,2,3,5-tetramethylpyrazolidin-4-yl)diazene.

Molecular Properties

Compound Nameethyl-(1,2,3,5-tetramethylpyrazolidin-4-yl)diazene
PubChem CID20644327
Molecular FormulaC9H20N4
Molecular Weight184.29 g/mol
Exact Mass184.17
IUPAC Nameethyl-(1,2,3,5-tetramethylpyrazolidin-4-yl)diazene
SMILESCC/N=N/C1C(C)N(C)N(C)C1C
InChIInChI=1S/C9H20N4/c1-6-10-11-9-7(2)12(4)13(5)8(9)3/h7-9H,6H2,1-5H3/b11-10+
InChIKeyVINKYPNHTTWBRB-ZHACJKMWSA-N
XLogP1.40
TPSA31.20 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.29
LogP ≤ 51.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of ethyl-(1,2,3,5-tetramethylpyrazolidin-4-yl)diazene?
The IUPAC name of ethyl-(1,2,3,5-tetramethylpyrazolidin-4-yl)diazene (CID 20644327) is ethyl-(1,2,3,5-tetramethylpyrazolidin-4-yl)diazene.
What is the SMILES notation for ethyl-(1,2,3,5-tetramethylpyrazolidin-4-yl)diazene?
The canonical SMILES for ethyl-(1,2,3,5-tetramethylpyrazolidin-4-yl)diazene is CC/N=N/C1C(C)N(C)N(C)C1C.
What is the InChIKey of ethyl-(1,2,3,5-tetramethylpyrazolidin-4-yl)diazene?
The InChIKey is VINKYPNHTTWBRB-ZHACJKMWSA-N. The full InChI is InChI=1S/C9H20N4/c1-6-10-11-9-7(2)12(4)13(5)8(9)3/h7-9H,6H2,1-5H3/b11-10+.
What are the key properties of ethyl-(1,2,3,5-tetramethylpyrazolidin-4-yl)diazene?
ethyl-(1,2,3,5-tetramethylpyrazolidin-4-yl)diazene has a molecular weight of 184.29 g/mol, XLogP of 1.40, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl-(1,2,3,5-tetramethylpyrazolidin-4-yl)diazene is sourced from PubChem (CID 20644327), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).