2-(2-butoxyethoxy)-N-(2,6-dimethoxy-3-pyridinyl)acetamide

C15H24N2O5 — CID 5224256

IUPAC2-(2-butoxyethoxy)-N-(2,6-dimethoxy-3-pyridinyl)acetamide
SMILESCCCCOCCOCC(=O)Nc1ccc(OC)nc1OC
InChIInChI=1S/C15H24N2O5/c1-4-5-8-21-9-10-22-11-13(18)16-12-6-7-14(19-2)17-15(12)20-3/h6-7H,4-5,8-11H2,1-3H3,(H,16,18)
InChIKeyGCJNMRLUAPPLPF-UHFFFAOYSA-N
MW312.37 g/mol
LogP1.87
Rot. Bonds11

About 2-(2-butoxyethoxy)-N-(2,6-dimethoxy-3-pyridinyl)acetamide

2-(2-butoxyethoxy)-N-(2,6-dimethoxy-3-pyridinyl)acetamide (PubChem CID 5224256) has the molecular formula C15H24N2O5 and a molecular weight of 312.37 g/mol. Its IUPAC name is 2-(2-butoxyethoxy)-N-(2,6-dimethoxy-3-pyridinyl)acetamide.

Molecular Properties

Compound Name2-(2-butoxyethoxy)-N-(2,6-dimethoxy-3-pyridinyl)acetamide
PubChem CID5224256
Molecular FormulaC15H24N2O5
Molecular Weight312.37 g/mol
Exact Mass312.17
IUPAC Name2-(2-butoxyethoxy)-N-(2,6-dimethoxy-3-pyridinyl)acetamide
SMILESCCCCOCCOCC(=O)Nc1ccc(OC)nc1OC
InChIInChI=1S/C15H24N2O5/c1-4-5-8-21-9-10-22-11-13(18)16-12-6-7-14(19-2)17-15(12)20-3/h6-7H,4-5,8-11H2,1-3H3,(H,16,18)
InChIKeyGCJNMRLUAPPLPF-UHFFFAOYSA-N
XLogP1.87
TPSA78.91 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds11
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.37
LogP ≤ 51.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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-(2-butoxyethoxy)-N-(2,6-dimethoxy-3-pyridinyl)acetamide?
The IUPAC name of 2-(2-butoxyethoxy)-N-(2,6-dimethoxy-3-pyridinyl)acetamide (CID 5224256) is 2-(2-butoxyethoxy)-N-(2,6-dimethoxy-3-pyridinyl)acetamide.
What is the SMILES notation for 2-(2-butoxyethoxy)-N-(2,6-dimethoxy-3-pyridinyl)acetamide?
The canonical SMILES for 2-(2-butoxyethoxy)-N-(2,6-dimethoxy-3-pyridinyl)acetamide is CCCCOCCOCC(=O)Nc1ccc(OC)nc1OC.
What is the InChIKey of 2-(2-butoxyethoxy)-N-(2,6-dimethoxy-3-pyridinyl)acetamide?
The InChIKey is GCJNMRLUAPPLPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O5/c1-4-5-8-21-9-10-22-11-13(18)16-12-6-7-14(19-2)17-15(12)20-3/h6-7H,4-5,8-11H2,1-3H3,(H,16,18).
What are the key properties of 2-(2-butoxyethoxy)-N-(2,6-dimethoxy-3-pyridinyl)acetamide?
2-(2-butoxyethoxy)-N-(2,6-dimethoxy-3-pyridinyl)acetamide has a molecular weight of 312.37 g/mol, XLogP of 1.87, 11 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-butoxyethoxy)-N-(2,6-dimethoxy-3-pyridinyl)acetamide is sourced from PubChem (CID 5224256), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).