N-methyl-3-(3-oxo-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyrazin-2-yl)propanamide

C9H15N5O2 — CID 66274048

IUPACN-methyl-3-(3-oxo-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyrazin-2-yl)propanamide
SMILESCNC(=O)CCn1nc2n(c1=O)CCNC2
InChIInChI=1S/C9H15N5O2/c1-10-8(15)2-4-14-9(16)13-5-3-11-6-7(13)12-14/h11H,2-6H2,1H3,(H,10,15)
InChIKeyLKAJXYWUNZPXGG-UHFFFAOYSA-N
MW225.25 g/mol
LogP-1.72
Rot. Bonds3

About N-methyl-3-(3-oxo-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyrazin-2-yl)propanamide

N-methyl-3-(3-oxo-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyrazin-2-yl)propanamide (PubChem CID 66274048) has the molecular formula C9H15N5O2 and a molecular weight of 225.25 g/mol. Its IUPAC name is N-methyl-3-(3-oxo-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyrazin-2-yl)propanamide.

Molecular Properties

Compound NameN-methyl-3-(3-oxo-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyrazin-2-yl)propanamide
PubChem CID66274048
Molecular FormulaC9H15N5O2
Molecular Weight225.25 g/mol
Exact Mass225.12
IUPAC NameN-methyl-3-(3-oxo-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyrazin-2-yl)propanamide
SMILESCNC(=O)CCn1nc2n(c1=O)CCNC2
InChIInChI=1S/C9H15N5O2/c1-10-8(15)2-4-14-9(16)13-5-3-11-6-7(13)12-14/h11H,2-6H2,1H3,(H,10,15)
InChIKeyLKAJXYWUNZPXGG-UHFFFAOYSA-N
XLogP-1.72
TPSA80.95 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.25
LogP ≤ 5-1.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze N-methyl-3-(3-oxo-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyrazin-2-yl)propanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-methyl-3-(3-oxo-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyrazin-2-yl)propanamide?
The IUPAC name of N-methyl-3-(3-oxo-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyrazin-2-yl)propanamide (CID 66274048) is N-methyl-3-(3-oxo-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyrazin-2-yl)propanamide.
What is the SMILES notation for N-methyl-3-(3-oxo-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyrazin-2-yl)propanamide?
The canonical SMILES for N-methyl-3-(3-oxo-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyrazin-2-yl)propanamide is CNC(=O)CCn1nc2n(c1=O)CCNC2.
What is the InChIKey of N-methyl-3-(3-oxo-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyrazin-2-yl)propanamide?
The InChIKey is LKAJXYWUNZPXGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N5O2/c1-10-8(15)2-4-14-9(16)13-5-3-11-6-7(13)12-14/h11H,2-6H2,1H3,(H,10,15).
What are the key properties of N-methyl-3-(3-oxo-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyrazin-2-yl)propanamide?
N-methyl-3-(3-oxo-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyrazin-2-yl)propanamide has a molecular weight of 225.25 g/mol, XLogP of -1.72, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-3-(3-oxo-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyrazin-2-yl)propanamide is sourced from PubChem (CID 66274048), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).