2-(5-amino-2-oxo-1-pyridinyl)-N-(2-cyclopropyl-2-hydroxyethyl)acetamide

C12H17N3O3 — CID 63294366

IUPAC2-(5-amino-2-oxo-1-pyridinyl)-N-(2-cyclopropyl-2-hydroxyethyl)acetamide
SMILESNc1ccc(=O)n(CC(=O)NCC(O)C2CC2)c1
InChIInChI=1S/C12H17N3O3/c13-9-3-4-12(18)15(6-9)7-11(17)14-5-10(16)8-1-2-8/h3-4,6,8,10,16H,1-2,5,7,13H2,(H,14,17)
InChIKeyOKPYUVJQRZXKTJ-UHFFFAOYSA-N
MW251.29 g/mol
LogP-0.68
Rot. Bonds5

About 2-(5-amino-2-oxo-1-pyridinyl)-N-(2-cyclopropyl-2-hydroxyethyl)acetamide

2-(5-amino-2-oxo-1-pyridinyl)-N-(2-cyclopropyl-2-hydroxyethyl)acetamide (PubChem CID 63294366) has the molecular formula C12H17N3O3 and a molecular weight of 251.29 g/mol. Its IUPAC name is 2-(5-amino-2-oxo-1-pyridinyl)-N-(2-cyclopropyl-2-hydroxyethyl)acetamide.

Molecular Properties

Compound Name2-(5-amino-2-oxo-1-pyridinyl)-N-(2-cyclopropyl-2-hydroxyethyl)acetamide
PubChem CID63294366
Molecular FormulaC12H17N3O3
Molecular Weight251.29 g/mol
Exact Mass251.13
IUPAC Name2-(5-amino-2-oxo-1-pyridinyl)-N-(2-cyclopropyl-2-hydroxyethyl)acetamide
SMILESNc1ccc(=O)n(CC(=O)NCC(O)C2CC2)c1
InChIInChI=1S/C12H17N3O3/c13-9-3-4-12(18)15(6-9)7-11(17)14-5-10(16)8-1-2-8/h3-4,6,8,10,16H,1-2,5,7,13H2,(H,14,17)
InChIKeyOKPYUVJQRZXKTJ-UHFFFAOYSA-N
XLogP-0.68
TPSA97.35 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.29
LogP ≤ 5-0.68
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(5-amino-2-oxo-1-pyridinyl)-N-(2-cyclopropyl-2-hydroxyethyl)acetamide?
The IUPAC name of 2-(5-amino-2-oxo-1-pyridinyl)-N-(2-cyclopropyl-2-hydroxyethyl)acetamide (CID 63294366) is 2-(5-amino-2-oxo-1-pyridinyl)-N-(2-cyclopropyl-2-hydroxyethyl)acetamide.
What is the SMILES notation for 2-(5-amino-2-oxo-1-pyridinyl)-N-(2-cyclopropyl-2-hydroxyethyl)acetamide?
The canonical SMILES for 2-(5-amino-2-oxo-1-pyridinyl)-N-(2-cyclopropyl-2-hydroxyethyl)acetamide is Nc1ccc(=O)n(CC(=O)NCC(O)C2CC2)c1.
What is the InChIKey of 2-(5-amino-2-oxo-1-pyridinyl)-N-(2-cyclopropyl-2-hydroxyethyl)acetamide?
The InChIKey is OKPYUVJQRZXKTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17N3O3/c13-9-3-4-12(18)15(6-9)7-11(17)14-5-10(16)8-1-2-8/h3-4,6,8,10,16H,1-2,5,7,13H2,(H,14,17).
What are the key properties of 2-(5-amino-2-oxo-1-pyridinyl)-N-(2-cyclopropyl-2-hydroxyethyl)acetamide?
2-(5-amino-2-oxo-1-pyridinyl)-N-(2-cyclopropyl-2-hydroxyethyl)acetamide has a molecular weight of 251.29 g/mol, XLogP of -0.68, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-amino-2-oxo-1-pyridinyl)-N-(2-cyclopropyl-2-hydroxyethyl)acetamide is sourced from PubChem (CID 63294366), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).