2-(5-amino-2-oxo-1-pyridinyl)-N-[2-(4-methyl-1,2,4-triazol-3-yl)ethyl]acetamide

C12H16N6O2 — CID 63329061

IUPAC2-(5-amino-2-oxo-1-pyridinyl)-N-[2-(4-methyl-1,2,4-triazol-3-yl)ethyl]acetamide
SMILESCn1cnnc1CCNC(=O)Cn1cc(N)ccc1=O
InChIInChI=1S/C12H16N6O2/c1-17-8-15-16-10(17)4-5-14-11(19)7-18-6-9(13)2-3-12(18)20/h2-3,6,8H,4-5,7,13H2,1H3,(H,14,19)
InChIKeyGUCSJRRHHPJVTJ-UHFFFAOYSA-N
MW276.30 g/mol
LogP-1.08
Rot. Bonds5

About 2-(5-amino-2-oxo-1-pyridinyl)-N-[2-(4-methyl-1,2,4-triazol-3-yl)ethyl]acetamide

2-(5-amino-2-oxo-1-pyridinyl)-N-[2-(4-methyl-1,2,4-triazol-3-yl)ethyl]acetamide (PubChem CID 63329061) has the molecular formula C12H16N6O2 and a molecular weight of 276.30 g/mol. Its IUPAC name is 2-(5-amino-2-oxo-1-pyridinyl)-N-[2-(4-methyl-1,2,4-triazol-3-yl)ethyl]acetamide.

Molecular Properties

Compound Name2-(5-amino-2-oxo-1-pyridinyl)-N-[2-(4-methyl-1,2,4-triazol-3-yl)ethyl]acetamide
PubChem CID63329061
Molecular FormulaC12H16N6O2
Molecular Weight276.30 g/mol
Exact Mass276.13
IUPAC Name2-(5-amino-2-oxo-1-pyridinyl)-N-[2-(4-methyl-1,2,4-triazol-3-yl)ethyl]acetamide
SMILESCn1cnnc1CCNC(=O)Cn1cc(N)ccc1=O
InChIInChI=1S/C12H16N6O2/c1-17-8-15-16-10(17)4-5-14-11(19)7-18-6-9(13)2-3-12(18)20/h2-3,6,8H,4-5,7,13H2,1H3,(H,14,19)
InChIKeyGUCSJRRHHPJVTJ-UHFFFAOYSA-N
XLogP-1.08
TPSA107.83 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.30
LogP ≤ 5-1.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 2-(5-amino-2-oxo-1-pyridinyl)-N-[2-(4-methyl-1,2,4-triazol-3-yl)ethyl]acetamide?
The IUPAC name of 2-(5-amino-2-oxo-1-pyridinyl)-N-[2-(4-methyl-1,2,4-triazol-3-yl)ethyl]acetamide (CID 63329061) is 2-(5-amino-2-oxo-1-pyridinyl)-N-[2-(4-methyl-1,2,4-triazol-3-yl)ethyl]acetamide.
What is the SMILES notation for 2-(5-amino-2-oxo-1-pyridinyl)-N-[2-(4-methyl-1,2,4-triazol-3-yl)ethyl]acetamide?
The canonical SMILES for 2-(5-amino-2-oxo-1-pyridinyl)-N-[2-(4-methyl-1,2,4-triazol-3-yl)ethyl]acetamide is Cn1cnnc1CCNC(=O)Cn1cc(N)ccc1=O.
What is the InChIKey of 2-(5-amino-2-oxo-1-pyridinyl)-N-[2-(4-methyl-1,2,4-triazol-3-yl)ethyl]acetamide?
The InChIKey is GUCSJRRHHPJVTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N6O2/c1-17-8-15-16-10(17)4-5-14-11(19)7-18-6-9(13)2-3-12(18)20/h2-3,6,8H,4-5,7,13H2,1H3,(H,14,19).
What are the key properties of 2-(5-amino-2-oxo-1-pyridinyl)-N-[2-(4-methyl-1,2,4-triazol-3-yl)ethyl]acetamide?
2-(5-amino-2-oxo-1-pyridinyl)-N-[2-(4-methyl-1,2,4-triazol-3-yl)ethyl]acetamide has a molecular weight of 276.30 g/mol, XLogP of -1.08, 5 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-amino-2-oxo-1-pyridinyl)-N-[2-(4-methyl-1,2,4-triazol-3-yl)ethyl]acetamide is sourced from PubChem (CID 63329061), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).