6-oxo-N-piperidin-4-yl-N-propyl-1H-pyrazine-3-carboxamide

C13H20N4O2 — CID 60805235

IUPAC6-oxo-N-piperidin-4-yl-N-propyl-1H-pyrazine-3-carboxamide
SMILESCCCN(C(=O)c1c[nH]c(=O)cn1)C1CCNCC1
InChIInChI=1S/C13H20N4O2/c1-2-7-17(10-3-5-14-6-4-10)13(19)11-8-16-12(18)9-15-11/h8-10,14H,2-7H2,1H3,(H,16,18)
InChIKeyNXEYVBBUYDKKIW-UHFFFAOYSA-N
MW264.33 g/mol
LogP0.37
Rot. Bonds4

About 6-oxo-N-piperidin-4-yl-N-propyl-1H-pyrazine-3-carboxamide

6-oxo-N-piperidin-4-yl-N-propyl-1H-pyrazine-3-carboxamide (PubChem CID 60805235) has the molecular formula C13H20N4O2 and a molecular weight of 264.33 g/mol. Its IUPAC name is 6-oxo-N-piperidin-4-yl-N-propyl-1H-pyrazine-3-carboxamide.

Molecular Properties

Compound Name6-oxo-N-piperidin-4-yl-N-propyl-1H-pyrazine-3-carboxamide
PubChem CID60805235
Molecular FormulaC13H20N4O2
Molecular Weight264.33 g/mol
Exact Mass264.16
IUPAC Name6-oxo-N-piperidin-4-yl-N-propyl-1H-pyrazine-3-carboxamide
SMILESCCCN(C(=O)c1c[nH]c(=O)cn1)C1CCNCC1
InChIInChI=1S/C13H20N4O2/c1-2-7-17(10-3-5-14-6-4-10)13(19)11-8-16-12(18)9-15-11/h8-10,14H,2-7H2,1H3,(H,16,18)
InChIKeyNXEYVBBUYDKKIW-UHFFFAOYSA-N
XLogP0.37
TPSA78.09 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.33
LogP ≤ 50.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-oxo-N-piperidin-4-yl-N-propyl-1H-pyrazine-3-carboxamide?
The IUPAC name of 6-oxo-N-piperidin-4-yl-N-propyl-1H-pyrazine-3-carboxamide (CID 60805235) is 6-oxo-N-piperidin-4-yl-N-propyl-1H-pyrazine-3-carboxamide.
What is the SMILES notation for 6-oxo-N-piperidin-4-yl-N-propyl-1H-pyrazine-3-carboxamide?
The canonical SMILES for 6-oxo-N-piperidin-4-yl-N-propyl-1H-pyrazine-3-carboxamide is CCCN(C(=O)c1c[nH]c(=O)cn1)C1CCNCC1.
What is the InChIKey of 6-oxo-N-piperidin-4-yl-N-propyl-1H-pyrazine-3-carboxamide?
The InChIKey is NXEYVBBUYDKKIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N4O2/c1-2-7-17(10-3-5-14-6-4-10)13(19)11-8-16-12(18)9-15-11/h8-10,14H,2-7H2,1H3,(H,16,18).
What are the key properties of 6-oxo-N-piperidin-4-yl-N-propyl-1H-pyrazine-3-carboxamide?
6-oxo-N-piperidin-4-yl-N-propyl-1H-pyrazine-3-carboxamide has a molecular weight of 264.33 g/mol, XLogP of 0.37, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-oxo-N-piperidin-4-yl-N-propyl-1H-pyrazine-3-carboxamide is sourced from PubChem (CID 60805235), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).