2-[4-[(3-oxo-4-propylpyrazin-2-yl)amino]piperidin-1-yl]acetamide

C14H23N5O2 — CID 62939512

IUPAC2-[4-[(3-oxo-4-propylpyrazin-2-yl)amino]piperidin-1-yl]acetamide
SMILESCCCn1ccnc(NC2CCN(CC(N)=O)CC2)c1=O
InChIInChI=1S/C14H23N5O2/c1-2-6-19-9-5-16-13(14(19)21)17-11-3-7-18(8-4-11)10-12(15)20/h5,9,11H,2-4,6-8,10H2,1H3,(H2,15,20)(H,16,17)
InChIKeyWHVBJBKHQMVAEK-UHFFFAOYSA-N
MW293.37 g/mol
LogP0.01
Rot. Bonds6

About 2-[4-[(3-oxo-4-propylpyrazin-2-yl)amino]piperidin-1-yl]acetamide

2-[4-[(3-oxo-4-propylpyrazin-2-yl)amino]piperidin-1-yl]acetamide (PubChem CID 62939512) has the molecular formula C14H23N5O2 and a molecular weight of 293.37 g/mol. Its IUPAC name is 2-[4-[(3-oxo-4-propylpyrazin-2-yl)amino]piperidin-1-yl]acetamide.

Molecular Properties

Compound Name2-[4-[(3-oxo-4-propylpyrazin-2-yl)amino]piperidin-1-yl]acetamide
PubChem CID62939512
Molecular FormulaC14H23N5O2
Molecular Weight293.37 g/mol
Exact Mass293.19
IUPAC Name2-[4-[(3-oxo-4-propylpyrazin-2-yl)amino]piperidin-1-yl]acetamide
SMILESCCCn1ccnc(NC2CCN(CC(N)=O)CC2)c1=O
InChIInChI=1S/C14H23N5O2/c1-2-6-19-9-5-16-13(14(19)21)17-11-3-7-18(8-4-11)10-12(15)20/h5,9,11H,2-4,6-8,10H2,1H3,(H2,15,20)(H,16,17)
InChIKeyWHVBJBKHQMVAEK-UHFFFAOYSA-N
XLogP0.01
TPSA93.25 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.37
LogP ≤ 50.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-[4-[(3-oxo-4-propylpyrazin-2-yl)amino]piperidin-1-yl]acetamide?
The IUPAC name of 2-[4-[(3-oxo-4-propylpyrazin-2-yl)amino]piperidin-1-yl]acetamide (CID 62939512) is 2-[4-[(3-oxo-4-propylpyrazin-2-yl)amino]piperidin-1-yl]acetamide.
What is the SMILES notation for 2-[4-[(3-oxo-4-propylpyrazin-2-yl)amino]piperidin-1-yl]acetamide?
The canonical SMILES for 2-[4-[(3-oxo-4-propylpyrazin-2-yl)amino]piperidin-1-yl]acetamide is CCCn1ccnc(NC2CCN(CC(N)=O)CC2)c1=O.
What is the InChIKey of 2-[4-[(3-oxo-4-propylpyrazin-2-yl)amino]piperidin-1-yl]acetamide?
The InChIKey is WHVBJBKHQMVAEK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N5O2/c1-2-6-19-9-5-16-13(14(19)21)17-11-3-7-18(8-4-11)10-12(15)20/h5,9,11H,2-4,6-8,10H2,1H3,(H2,15,20)(H,16,17).
What are the key properties of 2-[4-[(3-oxo-4-propylpyrazin-2-yl)amino]piperidin-1-yl]acetamide?
2-[4-[(3-oxo-4-propylpyrazin-2-yl)amino]piperidin-1-yl]acetamide has a molecular weight of 293.37 g/mol, XLogP of 0.01, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[(3-oxo-4-propylpyrazin-2-yl)amino]piperidin-1-yl]acetamide is sourced from PubChem (CID 62939512), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).