N-([1,2,4]triazolo[4,3-a]pyridin-3-yl)butanamide

C10H12N4O — CID 39030847

IUPACN-([1,2,4]triazolo[4,3-a]pyridin-3-yl)butanamide
SMILESCCCC(=O)Nc1nnc2ccccn12
InChIInChI=1S/C10H12N4O/c1-2-5-9(15)11-10-13-12-8-6-3-4-7-14(8)10/h3-4,6-7H,2,5H2,1H3,(H,11,13,15)
InChIKeyYMXAEBNJPKMLMA-UHFFFAOYSA-N
MW204.23 g/mol
LogP1.47
Rot. Bonds3

About N-([1,2,4]triazolo[4,3-a]pyridin-3-yl)butanamide

N-([1,2,4]triazolo[4,3-a]pyridin-3-yl)butanamide (PubChem CID 39030847) has the molecular formula C10H12N4O and a molecular weight of 204.23 g/mol. Its IUPAC name is N-([1,2,4]triazolo[4,3-a]pyridin-3-yl)butanamide.

Molecular Properties

Compound NameN-([1,2,4]triazolo[4,3-a]pyridin-3-yl)butanamide
PubChem CID39030847
Molecular FormulaC10H12N4O
Molecular Weight204.23 g/mol
Exact Mass204.10
IUPAC NameN-([1,2,4]triazolo[4,3-a]pyridin-3-yl)butanamide
SMILESCCCC(=O)Nc1nnc2ccccn12
InChIInChI=1S/C10H12N4O/c1-2-5-9(15)11-10-13-12-8-6-3-4-7-14(8)10/h3-4,6-7H,2,5H2,1H3,(H,11,13,15)
InChIKeyYMXAEBNJPKMLMA-UHFFFAOYSA-N
XLogP1.47
TPSA59.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.23
LogP ≤ 51.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-([1,2,4]triazolo[4,3-a]pyridin-3-yl)butanamide?
The IUPAC name of N-([1,2,4]triazolo[4,3-a]pyridin-3-yl)butanamide (CID 39030847) is N-([1,2,4]triazolo[4,3-a]pyridin-3-yl)butanamide.
What is the SMILES notation for N-([1,2,4]triazolo[4,3-a]pyridin-3-yl)butanamide?
The canonical SMILES for N-([1,2,4]triazolo[4,3-a]pyridin-3-yl)butanamide is CCCC(=O)Nc1nnc2ccccn12.
What is the InChIKey of N-([1,2,4]triazolo[4,3-a]pyridin-3-yl)butanamide?
The InChIKey is YMXAEBNJPKMLMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N4O/c1-2-5-9(15)11-10-13-12-8-6-3-4-7-14(8)10/h3-4,6-7H,2,5H2,1H3,(H,11,13,15).
What are the key properties of N-([1,2,4]triazolo[4,3-a]pyridin-3-yl)butanamide?
N-([1,2,4]triazolo[4,3-a]pyridin-3-yl)butanamide has a molecular weight of 204.23 g/mol, XLogP of 1.47, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-([1,2,4]triazolo[4,3-a]pyridin-3-yl)butanamide is sourced from PubChem (CID 39030847), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).