3-[(3-methyl-[1,2,4]triazolo[4,3-a]pyrazin-8-yl)amino]butanamide

C10H14N6O — CID 115685028

IUPAC3-[(3-methyl-[1,2,4]triazolo[4,3-a]pyrazin-8-yl)amino]butanamide
SMILESCc1nnc2c(NC(C)CC(N)=O)nccn12
InChIInChI=1S/C10H14N6O/c1-6(5-8(11)17)13-9-10-15-14-7(2)16(10)4-3-12-9/h3-4,6H,5H2,1-2H3,(H2,11,17)(H,12,13)
InChIKeyCIWBGMCHWJQMPC-UHFFFAOYSA-N
MW234.26 g/mol
LogP0.11
Rot. Bonds4

About 3-[(3-methyl-[1,2,4]triazolo[4,3-a]pyrazin-8-yl)amino]butanamide

3-[(3-methyl-[1,2,4]triazolo[4,3-a]pyrazin-8-yl)amino]butanamide (PubChem CID 115685028) has the molecular formula C10H14N6O and a molecular weight of 234.26 g/mol. Its IUPAC name is 3-[(3-methyl-[1,2,4]triazolo[4,3-a]pyrazin-8-yl)amino]butanamide.

Molecular Properties

Compound Name3-[(3-methyl-[1,2,4]triazolo[4,3-a]pyrazin-8-yl)amino]butanamide
PubChem CID115685028
Molecular FormulaC10H14N6O
Molecular Weight234.26 g/mol
Exact Mass234.12
IUPAC Name3-[(3-methyl-[1,2,4]triazolo[4,3-a]pyrazin-8-yl)amino]butanamide
SMILESCc1nnc2c(NC(C)CC(N)=O)nccn12
InChIInChI=1S/C10H14N6O/c1-6(5-8(11)17)13-9-10-15-14-7(2)16(10)4-3-12-9/h3-4,6H,5H2,1-2H3,(H2,11,17)(H,12,13)
InChIKeyCIWBGMCHWJQMPC-UHFFFAOYSA-N
XLogP0.11
TPSA98.20 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.26
LogP ≤ 50.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 3-[(3-methyl-[1,2,4]triazolo[4,3-a]pyrazin-8-yl)amino]butanamide 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 3-[(3-methyl-[1,2,4]triazolo[4,3-a]pyrazin-8-yl)amino]butanamide?
The IUPAC name of 3-[(3-methyl-[1,2,4]triazolo[4,3-a]pyrazin-8-yl)amino]butanamide (CID 115685028) is 3-[(3-methyl-[1,2,4]triazolo[4,3-a]pyrazin-8-yl)amino]butanamide.
What is the SMILES notation for 3-[(3-methyl-[1,2,4]triazolo[4,3-a]pyrazin-8-yl)amino]butanamide?
The canonical SMILES for 3-[(3-methyl-[1,2,4]triazolo[4,3-a]pyrazin-8-yl)amino]butanamide is Cc1nnc2c(NC(C)CC(N)=O)nccn12.
What is the InChIKey of 3-[(3-methyl-[1,2,4]triazolo[4,3-a]pyrazin-8-yl)amino]butanamide?
The InChIKey is CIWBGMCHWJQMPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N6O/c1-6(5-8(11)17)13-9-10-15-14-7(2)16(10)4-3-12-9/h3-4,6H,5H2,1-2H3,(H2,11,17)(H,12,13).
What are the key properties of 3-[(3-methyl-[1,2,4]triazolo[4,3-a]pyrazin-8-yl)amino]butanamide?
3-[(3-methyl-[1,2,4]triazolo[4,3-a]pyrazin-8-yl)amino]butanamide has a molecular weight of 234.26 g/mol, XLogP of 0.11, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(3-methyl-[1,2,4]triazolo[4,3-a]pyrazin-8-yl)amino]butanamide is sourced from PubChem (CID 115685028), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).