Amino N-[2-[ethyl(methyl)amino]ethyl]-N-methylcarbamate

C₇H₁₇N₃O₂ — CID 172721921

About Amino N-[2-[ethyl(methyl)amino]ethyl]-N-methylcarbamate

Amino N-[2-[ethyl(methyl)amino]ethyl]-N-methylcarbamate (PubChem CID 172721921) has the molecular formula C₇H₁₇N₃O₂ and a molecular weight of 175.23 g/mol. Its IUPAC name is amino N-[2-[ethyl(methyl)amino]ethyl]-N-methylcarbamate.

Molecular Properties

• Compound Name: Amino N-[2-[ethyl(methyl)amino]ethyl]-N-methylcarbamate
• PubChem CID: 172721921
• Molecular Formula: C₇H₁₇N₃O₂
• Molecular Weight: 175.23 g/mol
• Exact Mass: 175.13
• IUPAC Name: amino N-[2-[ethyl(methyl)amino]ethyl]-N-methylcarbamate
• SMILES: CCN(C)CCN(C)C(=O)ON
• InChI: InChI=1S/C7H17N3O2/c1-4-9(2)5-6-10(3)7(11)12-8/h4-6,8H2,1-3H3
• InChIKey: GPZIDKPUEFIYFI-UHFFFAOYSA-N
• XLogP: -0.12
• TPSA: 58.80 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 4
• Rotatable Bonds: 4
• Heavy Atoms: 12
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	175.23
LogP ≤ 5	-0.12
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	4

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of Amino N-[2-[ethyl(methyl)amino]ethyl]-N-methylcarbamate?

The IUPAC name of Amino N-[2-[ethyl(methyl)amino]ethyl]-N-methylcarbamate (CID 172721921) is amino N-[2-[ethyl(methyl)amino]ethyl]-N-methylcarbamate.

What is the SMILES notation for Amino N-[2-[ethyl(methyl)amino]ethyl]-N-methylcarbamate?

The canonical SMILES for Amino N-[2-[ethyl(methyl)amino]ethyl]-N-methylcarbamate is CCN(C)CCN(C)C(=O)ON.

What is the InChIKey of Amino N-[2-[ethyl(methyl)amino]ethyl]-N-methylcarbamate?

The InChIKey is GPZIDKPUEFIYFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H17N3O2/c1-4-9(2)5-6-10(3)7(11)12-8/h4-6,8H2,1-3H3.

What are the key properties of Amino N-[2-[ethyl(methyl)amino]ethyl]-N-methylcarbamate?

Amino N-[2-[ethyl(methyl)amino]ethyl]-N-methylcarbamate has a molecular weight of 175.23 g/mol, XLogP of -0.12, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for Amino N-[2-[ethyl(methyl)amino]ethyl]-N-methylcarbamate is sourced from PubChem (CID 172721921), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

Sources

• PubChem CID 172721921 — identifiers, structure, computed properties (public domain)

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