2-ethoxy-N-[2-(3-pyridin-2-ylpyrazol-1-yl)ethyl]acetamide

C14H18N4O2 — CID 71807894

IUPAC2-ethoxy-N-[2-(3-pyridin-2-ylpyrazol-1-yl)ethyl]acetamide
SMILESCCOCC(=O)NCCn1ccc(-c2ccccn2)n1
InChIInChI=1S/C14H18N4O2/c1-2-20-11-14(19)16-8-10-18-9-6-13(17-18)12-5-3-4-7-15-12/h3-7,9H,2,8,10-11H2,1H3,(H,16,19)
InChIKeyLHGODTKANHLHHN-UHFFFAOYSA-N
MW274.32 g/mol
LogP1.10
Rot. Bonds7

About 2-ethoxy-N-[2-(3-pyridin-2-ylpyrazol-1-yl)ethyl]acetamide

2-ethoxy-N-[2-(3-pyridin-2-ylpyrazol-1-yl)ethyl]acetamide (PubChem CID 71807894) has the molecular formula C14H18N4O2 and a molecular weight of 274.32 g/mol. Its IUPAC name is 2-ethoxy-N-[2-(3-pyridin-2-ylpyrazol-1-yl)ethyl]acetamide.

Molecular Properties

Compound Name2-ethoxy-N-[2-(3-pyridin-2-ylpyrazol-1-yl)ethyl]acetamide
PubChem CID71807894
Molecular FormulaC14H18N4O2
Molecular Weight274.32 g/mol
Exact Mass274.14
IUPAC Name2-ethoxy-N-[2-(3-pyridin-2-ylpyrazol-1-yl)ethyl]acetamide
SMILESCCOCC(=O)NCCn1ccc(-c2ccccn2)n1
InChIInChI=1S/C14H18N4O2/c1-2-20-11-14(19)16-8-10-18-9-6-13(17-18)12-5-3-4-7-15-12/h3-7,9H,2,8,10-11H2,1H3,(H,16,19)
InChIKeyLHGODTKANHLHHN-UHFFFAOYSA-N
XLogP1.10
TPSA69.04 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.32
LogP ≤ 51.10
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-(3-pyridin-2-ylpyrazol-1-yl)ethyl]acetamide?
The IUPAC name of 2-ethoxy-N-[2-(3-pyridin-2-ylpyrazol-1-yl)ethyl]acetamide (CID 71807894) is 2-ethoxy-N-[2-(3-pyridin-2-ylpyrazol-1-yl)ethyl]acetamide.
What is the SMILES notation for 2-ethoxy-N-[2-(3-pyridin-2-ylpyrazol-1-yl)ethyl]acetamide?
The canonical SMILES for 2-ethoxy-N-[2-(3-pyridin-2-ylpyrazol-1-yl)ethyl]acetamide is CCOCC(=O)NCCn1ccc(-c2ccccn2)n1.
What is the InChIKey of 2-ethoxy-N-[2-(3-pyridin-2-ylpyrazol-1-yl)ethyl]acetamide?
The InChIKey is LHGODTKANHLHHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N4O2/c1-2-20-11-14(19)16-8-10-18-9-6-13(17-18)12-5-3-4-7-15-12/h3-7,9H,2,8,10-11H2,1H3,(H,16,19).
What are the key properties of 2-ethoxy-N-[2-(3-pyridin-2-ylpyrazol-1-yl)ethyl]acetamide?
2-ethoxy-N-[2-(3-pyridin-2-ylpyrazol-1-yl)ethyl]acetamide has a molecular weight of 274.32 g/mol, XLogP of 1.10, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-N-[2-(3-pyridin-2-ylpyrazol-1-yl)ethyl]acetamide is sourced from PubChem (CID 71807894), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).