2-piperidin-3-yl-N-(1,2,4-triazin-3-yl)acetamide

C10H15N5O — CID 114387894

IUPAC2-piperidin-3-yl-N-(1,2,4-triazin-3-yl)acetamide
SMILESO=C(CC1CCCNC1)Nc1nccnn1
InChIInChI=1S/C10H15N5O/c16-9(6-8-2-1-3-11-7-8)14-10-12-4-5-13-15-10/h4-5,8,11H,1-3,6-7H2,(H,12,14,15,16)
InChIKeyYEDYSVYMHMXIJD-UHFFFAOYSA-N
MW221.26 g/mol
LogP0.20
Rot. Bonds3

About 2-piperidin-3-yl-N-(1,2,4-triazin-3-yl)acetamide

2-piperidin-3-yl-N-(1,2,4-triazin-3-yl)acetamide (PubChem CID 114387894) has the molecular formula C10H15N5O and a molecular weight of 221.26 g/mol. Its IUPAC name is 2-piperidin-3-yl-N-(1,2,4-triazin-3-yl)acetamide.

Molecular Properties

Compound Name2-piperidin-3-yl-N-(1,2,4-triazin-3-yl)acetamide
PubChem CID114387894
Molecular FormulaC10H15N5O
Molecular Weight221.26 g/mol
Exact Mass221.13
IUPAC Name2-piperidin-3-yl-N-(1,2,4-triazin-3-yl)acetamide
SMILESO=C(CC1CCCNC1)Nc1nccnn1
InChIInChI=1S/C10H15N5O/c16-9(6-8-2-1-3-11-7-8)14-10-12-4-5-13-15-10/h4-5,8,11H,1-3,6-7H2,(H,12,14,15,16)
InChIKeyYEDYSVYMHMXIJD-UHFFFAOYSA-N
XLogP0.20
TPSA79.80 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.26
LogP ≤ 50.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-piperidin-3-yl-N-(1,2,4-triazin-3-yl)acetamide?
The IUPAC name of 2-piperidin-3-yl-N-(1,2,4-triazin-3-yl)acetamide (CID 114387894) is 2-piperidin-3-yl-N-(1,2,4-triazin-3-yl)acetamide.
What is the SMILES notation for 2-piperidin-3-yl-N-(1,2,4-triazin-3-yl)acetamide?
The canonical SMILES for 2-piperidin-3-yl-N-(1,2,4-triazin-3-yl)acetamide is O=C(CC1CCCNC1)Nc1nccnn1.
What is the InChIKey of 2-piperidin-3-yl-N-(1,2,4-triazin-3-yl)acetamide?
The InChIKey is YEDYSVYMHMXIJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N5O/c16-9(6-8-2-1-3-11-7-8)14-10-12-4-5-13-15-10/h4-5,8,11H,1-3,6-7H2,(H,12,14,15,16).
What are the key properties of 2-piperidin-3-yl-N-(1,2,4-triazin-3-yl)acetamide?
2-piperidin-3-yl-N-(1,2,4-triazin-3-yl)acetamide has a molecular weight of 221.26 g/mol, XLogP of 0.20, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-piperidin-3-yl-N-(1,2,4-triazin-3-yl)acetamide is sourced from PubChem (CID 114387894), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).