N'-[(Z)-but-2-en-2-yl]-N-ethylideneethanimidamide;ethane

C₁₀H₂₀N₂ — CID 143082462

About N'-[(Z)-but-2-en-2-yl]-N-ethylideneethanimidamide;ethane

N'-[(Z)-but-2-en-2-yl]-N-ethylideneethanimidamide;ethane (PubChem CID 143082462) has the molecular formula C₁₀H₂₀N₂ and a molecular weight of 168.28 g/mol. Its IUPAC name is N'-[(Z)-but-2-en-2-yl]-N-ethylideneethanimidamide;ethane.

Molecular Properties

• Compound Name: N'-[(Z)-but-2-en-2-yl]-N-ethylideneethanimidamide;ethane
• PubChem CID: 143082462
• Molecular Formula: C₁₀H₂₀N₂
• Molecular Weight: 168.28 g/mol
• Exact Mass: 168.16
• IUPAC Name: N'-[(Z)-but-2-en-2-yl]-N-ethylideneethanimidamide;ethane
• SMILES: C/C=C(C)\N=C(C)\N=C\C.CC
• InChI: InChI=1S/C8H14N2.C2H6/c1-5-7(3)10-8(4)9-6-2;1-2/h5-6H,1-4H3;1-2H3/b7-5-,9-6+,10-8+
• InChIKey: YZJCMVYEVZQWPZ-BIEUWWLHSA-N
• XLogP: 3.45
• TPSA: 24.72 Ų
• H-Bond Acceptors: 1
• Rotatable Bonds: 1
• Heavy Atoms: 12
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	168.28
LogP ≤ 5	3.45
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	1

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of N'-[(Z)-but-2-en-2-yl]-N-ethylideneethanimidamide;ethane?

The IUPAC name of N'-[(Z)-but-2-en-2-yl]-N-ethylideneethanimidamide;ethane (CID 143082462) is N'-[(Z)-but-2-en-2-yl]-N-ethylideneethanimidamide;ethane.

What is the SMILES notation for N'-[(Z)-but-2-en-2-yl]-N-ethylideneethanimidamide;ethane?

The canonical SMILES for N'-[(Z)-but-2-en-2-yl]-N-ethylideneethanimidamide;ethane is C/C=C(C)\N=C(C)\N=C\C.CC.

What is the InChIKey of N'-[(Z)-but-2-en-2-yl]-N-ethylideneethanimidamide;ethane?

The InChIKey is YZJCMVYEVZQWPZ-BIEUWWLHSA-N. The full InChI is InChI=1S/C8H14N2.C2H6/c1-5-7(3)10-8(4)9-6-2;1-2/h5-6H,1-4H3;1-2H3/b7-5-,9-6+,10-8+;.

What are the key properties of N'-[(Z)-but-2-en-2-yl]-N-ethylideneethanimidamide;ethane?

N'-[(Z)-but-2-en-2-yl]-N-ethylideneethanimidamide;ethane has a molecular weight of 168.28 g/mol, XLogP of 3.45, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.

Where does this data come from?

All data for N'-[(Z)-but-2-en-2-yl]-N-ethylideneethanimidamide;ethane is sourced from PubChem (CID 143082462), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

Sources

• PubChem CID 143082462 — identifiers, structure, computed properties (public domain)

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