2-[(3-oxo-4-propylpyrazin-2-yl)amino]-N-propylpropanamide

C13H22N4O2 — CID 55155269

IUPAC2-[(3-oxo-4-propylpyrazin-2-yl)amino]-N-propylpropanamide
SMILESCCCNC(=O)C(C)Nc1nccn(CCC)c1=O
InChIInChI=1S/C13H22N4O2/c1-4-6-15-12(18)10(3)16-11-13(19)17(8-5-2)9-7-14-11/h7,9-10H,4-6,8H2,1-3H3,(H,14,16)(H,15,18)
InChIKeyUYFDSXANKQITCA-UHFFFAOYSA-N
MW266.34 g/mol
LogP0.98
Rot. Bonds7

About 2-[(3-oxo-4-propylpyrazin-2-yl)amino]-N-propylpropanamide

2-[(3-oxo-4-propylpyrazin-2-yl)amino]-N-propylpropanamide (PubChem CID 55155269) has the molecular formula C13H22N4O2 and a molecular weight of 266.34 g/mol. Its IUPAC name is 2-[(3-oxo-4-propylpyrazin-2-yl)amino]-N-propylpropanamide.

Molecular Properties

Compound Name2-[(3-oxo-4-propylpyrazin-2-yl)amino]-N-propylpropanamide
PubChem CID55155269
Molecular FormulaC13H22N4O2
Molecular Weight266.34 g/mol
Exact Mass266.17
IUPAC Name2-[(3-oxo-4-propylpyrazin-2-yl)amino]-N-propylpropanamide
SMILESCCCNC(=O)C(C)Nc1nccn(CCC)c1=O
InChIInChI=1S/C13H22N4O2/c1-4-6-15-12(18)10(3)16-11-13(19)17(8-5-2)9-7-14-11/h7,9-10H,4-6,8H2,1-3H3,(H,14,16)(H,15,18)
InChIKeyUYFDSXANKQITCA-UHFFFAOYSA-N
XLogP0.98
TPSA76.02 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.34
LogP ≤ 50.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-[(3-oxo-4-propylpyrazin-2-yl)amino]-N-propylpropanamide?
The IUPAC name of 2-[(3-oxo-4-propylpyrazin-2-yl)amino]-N-propylpropanamide (CID 55155269) is 2-[(3-oxo-4-propylpyrazin-2-yl)amino]-N-propylpropanamide.
What is the SMILES notation for 2-[(3-oxo-4-propylpyrazin-2-yl)amino]-N-propylpropanamide?
The canonical SMILES for 2-[(3-oxo-4-propylpyrazin-2-yl)amino]-N-propylpropanamide is CCCNC(=O)C(C)Nc1nccn(CCC)c1=O.
What is the InChIKey of 2-[(3-oxo-4-propylpyrazin-2-yl)amino]-N-propylpropanamide?
The InChIKey is UYFDSXANKQITCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N4O2/c1-4-6-15-12(18)10(3)16-11-13(19)17(8-5-2)9-7-14-11/h7,9-10H,4-6,8H2,1-3H3,(H,14,16)(H,15,18).
What are the key properties of 2-[(3-oxo-4-propylpyrazin-2-yl)amino]-N-propylpropanamide?
2-[(3-oxo-4-propylpyrazin-2-yl)amino]-N-propylpropanamide has a molecular weight of 266.34 g/mol, XLogP of 0.98, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3-oxo-4-propylpyrazin-2-yl)amino]-N-propylpropanamide is sourced from PubChem (CID 55155269), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).