2-(dimethylamino)-N-methylidene-N'-prop-1-en-2-ylethanimidamide

C₈H₁₅N₃ — CID 142083163

About 2-(dimethylamino)-N-methylidene-N'-prop-1-en-2-ylethanimidamide

2-(dimethylamino)-N-methylidene-N'-prop-1-en-2-ylethanimidamide (PubChem CID 142083163) has the molecular formula C₈H₁₅N₃ and a molecular weight of 153.23 g/mol. Its IUPAC name is 2-(dimethylamino)-N-methylidene-N'-prop-1-en-2-ylethanimidamide.

Molecular Properties

• Compound Name: 2-(dimethylamino)-N-methylidene-N'-prop-1-en-2-ylethanimidamide
• PubChem CID: 142083163
• Molecular Formula: C₈H₁₅N₃
• Molecular Weight: 153.23 g/mol
• Exact Mass: 153.13
• IUPAC Name: 2-(dimethylamino)-N-methylidene-N'-prop-1-en-2-ylethanimidamide
• SMILES: C=N/C(CN(C)C)=N/C(=C)C
• InChI: InChI=1S/C8H15N3/c1-7(2)10-8(9-3)6-11(4)5/h1,3,6H2,2,4-5H3/b10-8+
• InChIKey: BKFFKJWPNJGGJF-CSKARUKUSA-N
• XLogP: 1.18
• TPSA: 27.96 Ų
• H-Bond Acceptors: 2
• Rotatable Bonds: 3
• Heavy Atoms: 11
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	153.23
LogP ≤ 5	1.18
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	2

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 2-(dimethylamino)-N-methylidene-N'-prop-1-en-2-ylethanimidamide?

The IUPAC name of 2-(dimethylamino)-N-methylidene-N'-prop-1-en-2-ylethanimidamide (CID 142083163) is 2-(dimethylamino)-N-methylidene-N'-prop-1-en-2-ylethanimidamide.

What is the SMILES notation for 2-(dimethylamino)-N-methylidene-N'-prop-1-en-2-ylethanimidamide?

The canonical SMILES for 2-(dimethylamino)-N-methylidene-N'-prop-1-en-2-ylethanimidamide is C=N/C(CN(C)C)=N/C(=C)C.

What is the InChIKey of 2-(dimethylamino)-N-methylidene-N'-prop-1-en-2-ylethanimidamide?

The InChIKey is BKFFKJWPNJGGJF-CSKARUKUSA-N. The full InChI is InChI=1S/C8H15N3/c1-7(2)10-8(9-3)6-11(4)5/h1,3,6H2,2,4-5H3/b10-8+.

What are the key properties of 2-(dimethylamino)-N-methylidene-N'-prop-1-en-2-ylethanimidamide?

2-(dimethylamino)-N-methylidene-N'-prop-1-en-2-ylethanimidamide has a molecular weight of 153.23 g/mol, XLogP of 1.18, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.

Where does this data come from?

All data for 2-(dimethylamino)-N-methylidene-N'-prop-1-en-2-ylethanimidamide is sourced from PubChem (CID 142083163), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

Sources

• PubChem CID 142083163 — identifiers, structure, computed properties (public domain)

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