2-methoxy-N-[3-(methylamino)propyl]-N-(2-methylpropyl)acetamide

C11H24N2O2 — CID 147604351

IUPAC2-methoxy-N-[3-(methylamino)propyl]-N-(2-methylpropyl)acetamide
SMILESCNCCCN(CC(C)C)C(=O)COC
InChIInChI=1S/C11H24N2O2/c1-10(2)8-13(7-5-6-12-3)11(14)9-15-4/h10,12H,5-9H2,1-4H3
InChIKeyGATNDVCNFFGQBK-UHFFFAOYSA-N
MW216.32 g/mol
LogP0.73
Rot. Bonds8

About 2-methoxy-N-[3-(methylamino)propyl]-N-(2-methylpropyl)acetamide

2-methoxy-N-[3-(methylamino)propyl]-N-(2-methylpropyl)acetamide (PubChem CID 147604351) has the molecular formula C11H24N2O2 and a molecular weight of 216.32 g/mol. Its IUPAC name is 2-methoxy-N-[3-(methylamino)propyl]-N-(2-methylpropyl)acetamide.

Molecular Properties

Compound Name2-methoxy-N-[3-(methylamino)propyl]-N-(2-methylpropyl)acetamide
PubChem CID147604351
Molecular FormulaC11H24N2O2
Molecular Weight216.32 g/mol
Exact Mass216.18
IUPAC Name2-methoxy-N-[3-(methylamino)propyl]-N-(2-methylpropyl)acetamide
SMILESCNCCCN(CC(C)C)C(=O)COC
InChIInChI=1S/C11H24N2O2/c1-10(2)8-13(7-5-6-12-3)11(14)9-15-4/h10,12H,5-9H2,1-4H3
InChIKeyGATNDVCNFFGQBK-UHFFFAOYSA-N
XLogP0.73
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.32
LogP ≤ 50.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-[3-(methylamino)propyl]-N-(2-methylpropyl)acetamide?
The IUPAC name of 2-methoxy-N-[3-(methylamino)propyl]-N-(2-methylpropyl)acetamide (CID 147604351) is 2-methoxy-N-[3-(methylamino)propyl]-N-(2-methylpropyl)acetamide.
What is the SMILES notation for 2-methoxy-N-[3-(methylamino)propyl]-N-(2-methylpropyl)acetamide?
The canonical SMILES for 2-methoxy-N-[3-(methylamino)propyl]-N-(2-methylpropyl)acetamide is CNCCCN(CC(C)C)C(=O)COC.
What is the InChIKey of 2-methoxy-N-[3-(methylamino)propyl]-N-(2-methylpropyl)acetamide?
The InChIKey is GATNDVCNFFGQBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O2/c1-10(2)8-13(7-5-6-12-3)11(14)9-15-4/h10,12H,5-9H2,1-4H3.
What are the key properties of 2-methoxy-N-[3-(methylamino)propyl]-N-(2-methylpropyl)acetamide?
2-methoxy-N-[3-(methylamino)propyl]-N-(2-methylpropyl)acetamide has a molecular weight of 216.32 g/mol, XLogP of 0.73, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-[3-(methylamino)propyl]-N-(2-methylpropyl)acetamide is sourced from PubChem (CID 147604351), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).