2-[(2-phenoxyacetyl)amino]-N-(2-pyridin-2-ylethyl)acetamide

C17H19N3O3 — CID 2548580

IUPAC2-[(2-phenoxyacetyl)amino]-N-(2-pyridin-2-ylethyl)acetamide
SMILESO=C(CNC(=O)COc1ccccc1)NCCc1ccccn1
InChIInChI=1S/C17H19N3O3/c21-16(19-11-9-14-6-4-5-10-18-14)12-20-17(22)13-23-15-7-2-1-3-8-15/h1-8,10H,9,11-13H2,(H,19,21)(H,20,22)
InChIKeyDXDYQRFTXSGXHO-UHFFFAOYSA-N
MW313.36 g/mol
LogP0.94
Rot. Bonds8

About 2-[(2-phenoxyacetyl)amino]-N-(2-pyridin-2-ylethyl)acetamide

2-[(2-phenoxyacetyl)amino]-N-(2-pyridin-2-ylethyl)acetamide (PubChem CID 2548580) has the molecular formula C17H19N3O3 and a molecular weight of 313.36 g/mol. Its IUPAC name is 2-[(2-phenoxyacetyl)amino]-N-(2-pyridin-2-ylethyl)acetamide.

Molecular Properties

Compound Name2-[(2-phenoxyacetyl)amino]-N-(2-pyridin-2-ylethyl)acetamide
PubChem CID2548580
Molecular FormulaC17H19N3O3
Molecular Weight313.36 g/mol
Exact Mass313.14
IUPAC Name2-[(2-phenoxyacetyl)amino]-N-(2-pyridin-2-ylethyl)acetamide
SMILESO=C(CNC(=O)COc1ccccc1)NCCc1ccccn1
InChIInChI=1S/C17H19N3O3/c21-16(19-11-9-14-6-4-5-10-18-14)12-20-17(22)13-23-15-7-2-1-3-8-15/h1-8,10H,9,11-13H2,(H,19,21)(H,20,22)
InChIKeyDXDYQRFTXSGXHO-UHFFFAOYSA-N
XLogP0.94
TPSA80.32 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.36
LogP ≤ 50.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[(2-phenoxyacetyl)amino]-N-(2-pyridin-2-ylethyl)acetamide?
The IUPAC name of 2-[(2-phenoxyacetyl)amino]-N-(2-pyridin-2-ylethyl)acetamide (CID 2548580) is 2-[(2-phenoxyacetyl)amino]-N-(2-pyridin-2-ylethyl)acetamide.
What is the SMILES notation for 2-[(2-phenoxyacetyl)amino]-N-(2-pyridin-2-ylethyl)acetamide?
The canonical SMILES for 2-[(2-phenoxyacetyl)amino]-N-(2-pyridin-2-ylethyl)acetamide is O=C(CNC(=O)COc1ccccc1)NCCc1ccccn1.
What is the InChIKey of 2-[(2-phenoxyacetyl)amino]-N-(2-pyridin-2-ylethyl)acetamide?
The InChIKey is DXDYQRFTXSGXHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N3O3/c21-16(19-11-9-14-6-4-5-10-18-14)12-20-17(22)13-23-15-7-2-1-3-8-15/h1-8,10H,9,11-13H2,(H,19,21)(H,20,22).
What are the key properties of 2-[(2-phenoxyacetyl)amino]-N-(2-pyridin-2-ylethyl)acetamide?
2-[(2-phenoxyacetyl)amino]-N-(2-pyridin-2-ylethyl)acetamide has a molecular weight of 313.36 g/mol, XLogP of 0.94, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-phenoxyacetyl)amino]-N-(2-pyridin-2-ylethyl)acetamide is sourced from PubChem (CID 2548580), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).