(6-acetamido-2-pyridinyl) acetate

C9H10N2O3 — CID 14208887

IUPAC(6-acetamido-2-pyridinyl) acetate
SMILESCC(=O)Nc1cccc(OC(C)=O)n1
InChIInChI=1S/C9H10N2O3/c1-6(12)10-8-4-3-5-9(11-8)14-7(2)13/h3-5H,1-2H3,(H,10,11,12)
InChIKeyYEQGMAHVMLHAFW-UHFFFAOYSA-N
MW194.19 g/mol
LogP0.97
Rot. Bonds2

About (6-acetamido-2-pyridinyl) acetate

(6-acetamido-2-pyridinyl) acetate (PubChem CID 14208887) has the molecular formula C9H10N2O3 and a molecular weight of 194.19 g/mol. Its IUPAC name is (6-acetamido-2-pyridinyl) acetate.

Molecular Properties

Compound Name(6-acetamido-2-pyridinyl) acetate
PubChem CID14208887
Molecular FormulaC9H10N2O3
Molecular Weight194.19 g/mol
Exact Mass194.07
IUPAC Name(6-acetamido-2-pyridinyl) acetate
SMILESCC(=O)Nc1cccc(OC(C)=O)n1
InChIInChI=1S/C9H10N2O3/c1-6(12)10-8-4-3-5-9(11-8)14-7(2)13/h3-5H,1-2H3,(H,10,11,12)
InChIKeyYEQGMAHVMLHAFW-UHFFFAOYSA-N
XLogP0.97
TPSA68.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.19
LogP ≤ 50.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze (6-acetamido-2-pyridinyl) acetate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (6-acetamido-2-pyridinyl) acetate?
The IUPAC name of (6-acetamido-2-pyridinyl) acetate (CID 14208887) is (6-acetamido-2-pyridinyl) acetate.
What is the SMILES notation for (6-acetamido-2-pyridinyl) acetate?
The canonical SMILES for (6-acetamido-2-pyridinyl) acetate is CC(=O)Nc1cccc(OC(C)=O)n1.
What is the InChIKey of (6-acetamido-2-pyridinyl) acetate?
The InChIKey is YEQGMAHVMLHAFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10N2O3/c1-6(12)10-8-4-3-5-9(11-8)14-7(2)13/h3-5H,1-2H3,(H,10,11,12).
What are the key properties of (6-acetamido-2-pyridinyl) acetate?
(6-acetamido-2-pyridinyl) acetate has a molecular weight of 194.19 g/mol, XLogP of 0.97, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (6-acetamido-2-pyridinyl) acetate is sourced from PubChem (CID 14208887), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).