2-ethoxy-N-[2-(2-methylimidazol-1-yl)-3-pyridinyl]acetamide

C13H16N4O2 — CID 61406197

IUPAC2-ethoxy-N-[2-(2-methylimidazol-1-yl)-3-pyridinyl]acetamide
SMILESCCOCC(=O)Nc1cccnc1-n1ccnc1C
InChIInChI=1S/C13H16N4O2/c1-3-19-9-12(18)16-11-5-4-6-15-13(11)17-8-7-14-10(17)2/h4-8H,3,9H2,1-2H3,(H,16,18)
InChIKeyBEIXFFSYLOIRHQ-UHFFFAOYSA-N
MW260.30 g/mol
LogP1.55
Rot. Bonds5

About 2-ethoxy-N-[2-(2-methylimidazol-1-yl)-3-pyridinyl]acetamide

2-ethoxy-N-[2-(2-methylimidazol-1-yl)-3-pyridinyl]acetamide (PubChem CID 61406197) has the molecular formula C13H16N4O2 and a molecular weight of 260.30 g/mol. Its IUPAC name is 2-ethoxy-N-[2-(2-methylimidazol-1-yl)-3-pyridinyl]acetamide.

Molecular Properties

Compound Name2-ethoxy-N-[2-(2-methylimidazol-1-yl)-3-pyridinyl]acetamide
PubChem CID61406197
Molecular FormulaC13H16N4O2
Molecular Weight260.30 g/mol
Exact Mass260.13
IUPAC Name2-ethoxy-N-[2-(2-methylimidazol-1-yl)-3-pyridinyl]acetamide
SMILESCCOCC(=O)Nc1cccnc1-n1ccnc1C
InChIInChI=1S/C13H16N4O2/c1-3-19-9-12(18)16-11-5-4-6-15-13(11)17-8-7-14-10(17)2/h4-8H,3,9H2,1-2H3,(H,16,18)
InChIKeyBEIXFFSYLOIRHQ-UHFFFAOYSA-N
XLogP1.55
TPSA69.04 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.30
LogP ≤ 51.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-N-[2-(2-methylimidazol-1-yl)-3-pyridinyl]acetamide?
The IUPAC name of 2-ethoxy-N-[2-(2-methylimidazol-1-yl)-3-pyridinyl]acetamide (CID 61406197) is 2-ethoxy-N-[2-(2-methylimidazol-1-yl)-3-pyridinyl]acetamide.
What is the SMILES notation for 2-ethoxy-N-[2-(2-methylimidazol-1-yl)-3-pyridinyl]acetamide?
The canonical SMILES for 2-ethoxy-N-[2-(2-methylimidazol-1-yl)-3-pyridinyl]acetamide is CCOCC(=O)Nc1cccnc1-n1ccnc1C.
What is the InChIKey of 2-ethoxy-N-[2-(2-methylimidazol-1-yl)-3-pyridinyl]acetamide?
The InChIKey is BEIXFFSYLOIRHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N4O2/c1-3-19-9-12(18)16-11-5-4-6-15-13(11)17-8-7-14-10(17)2/h4-8H,3,9H2,1-2H3,(H,16,18).
What are the key properties of 2-ethoxy-N-[2-(2-methylimidazol-1-yl)-3-pyridinyl]acetamide?
2-ethoxy-N-[2-(2-methylimidazol-1-yl)-3-pyridinyl]acetamide has a molecular weight of 260.30 g/mol, XLogP of 1.55, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-N-[2-(2-methylimidazol-1-yl)-3-pyridinyl]acetamide is sourced from PubChem (CID 61406197), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).