2-(5-amino-2-oxo-1-pyridinyl)-N-[4-(hydroxymethyl)oxan-4-yl]acetamide

C13H19N3O4 — CID 106296688

IUPAC2-(5-amino-2-oxo-1-pyridinyl)-N-[4-(hydroxymethyl)oxan-4-yl]acetamide
SMILESNc1ccc(=O)n(CC(=O)NC2(CO)CCOCC2)c1
InChIInChI=1S/C13H19N3O4/c14-10-1-2-12(19)16(7-10)8-11(18)15-13(9-17)3-5-20-6-4-13/h1-2,7,17H,3-6,8-9,14H2,(H,15,18)
InChIKeyFEJTUVFBCOGOJZ-UHFFFAOYSA-N
MW281.31 g/mol
LogP-0.91
Rot. Bonds4

About 2-(5-amino-2-oxo-1-pyridinyl)-N-[4-(hydroxymethyl)oxan-4-yl]acetamide

2-(5-amino-2-oxo-1-pyridinyl)-N-[4-(hydroxymethyl)oxan-4-yl]acetamide (PubChem CID 106296688) has the molecular formula C13H19N3O4 and a molecular weight of 281.31 g/mol. Its IUPAC name is 2-(5-amino-2-oxo-1-pyridinyl)-N-[4-(hydroxymethyl)oxan-4-yl]acetamide.

Molecular Properties

Compound Name2-(5-amino-2-oxo-1-pyridinyl)-N-[4-(hydroxymethyl)oxan-4-yl]acetamide
PubChem CID106296688
Molecular FormulaC13H19N3O4
Molecular Weight281.31 g/mol
Exact Mass281.14
IUPAC Name2-(5-amino-2-oxo-1-pyridinyl)-N-[4-(hydroxymethyl)oxan-4-yl]acetamide
SMILESNc1ccc(=O)n(CC(=O)NC2(CO)CCOCC2)c1
InChIInChI=1S/C13H19N3O4/c14-10-1-2-12(19)16(7-10)8-11(18)15-13(9-17)3-5-20-6-4-13/h1-2,7,17H,3-6,8-9,14H2,(H,15,18)
InChIKeyFEJTUVFBCOGOJZ-UHFFFAOYSA-N
XLogP-0.91
TPSA106.58 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.31
LogP ≤ 5-0.91
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-(5-amino-2-oxo-1-pyridinyl)-N-[4-(hydroxymethyl)oxan-4-yl]acetamide?
The IUPAC name of 2-(5-amino-2-oxo-1-pyridinyl)-N-[4-(hydroxymethyl)oxan-4-yl]acetamide (CID 106296688) is 2-(5-amino-2-oxo-1-pyridinyl)-N-[4-(hydroxymethyl)oxan-4-yl]acetamide.
What is the SMILES notation for 2-(5-amino-2-oxo-1-pyridinyl)-N-[4-(hydroxymethyl)oxan-4-yl]acetamide?
The canonical SMILES for 2-(5-amino-2-oxo-1-pyridinyl)-N-[4-(hydroxymethyl)oxan-4-yl]acetamide is Nc1ccc(=O)n(CC(=O)NC2(CO)CCOCC2)c1.
What is the InChIKey of 2-(5-amino-2-oxo-1-pyridinyl)-N-[4-(hydroxymethyl)oxan-4-yl]acetamide?
The InChIKey is FEJTUVFBCOGOJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3O4/c14-10-1-2-12(19)16(7-10)8-11(18)15-13(9-17)3-5-20-6-4-13/h1-2,7,17H,3-6,8-9,14H2,(H,15,18).
What are the key properties of 2-(5-amino-2-oxo-1-pyridinyl)-N-[4-(hydroxymethyl)oxan-4-yl]acetamide?
2-(5-amino-2-oxo-1-pyridinyl)-N-[4-(hydroxymethyl)oxan-4-yl]acetamide has a molecular weight of 281.31 g/mol, XLogP of -0.91, 4 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-amino-2-oxo-1-pyridinyl)-N-[4-(hydroxymethyl)oxan-4-yl]acetamide is sourced from PubChem (CID 106296688), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).