6-oxo-N-(2-piperidin-3-ylethyl)-1H-pyrazine-3-carboxamide

C12H18N4O2 — CID 63627861

IUPAC6-oxo-N-(2-piperidin-3-ylethyl)-1H-pyrazine-3-carboxamide
SMILESO=C(NCCC1CCCNC1)c1c[nH]c(=O)cn1
InChIInChI=1S/C12H18N4O2/c17-11-8-15-10(7-16-11)12(18)14-5-3-9-2-1-4-13-6-9/h7-9,13H,1-6H2,(H,14,18)(H,16,17)
InChIKeyFSEUYUOSONDWCJ-UHFFFAOYSA-N
MW250.30 g/mol
LogP-0.11
Rot. Bonds4

About 6-oxo-N-(2-piperidin-3-ylethyl)-1H-pyrazine-3-carboxamide

6-oxo-N-(2-piperidin-3-ylethyl)-1H-pyrazine-3-carboxamide (PubChem CID 63627861) has the molecular formula C12H18N4O2 and a molecular weight of 250.30 g/mol. Its IUPAC name is 6-oxo-N-(2-piperidin-3-ylethyl)-1H-pyrazine-3-carboxamide.

Molecular Properties

Compound Name6-oxo-N-(2-piperidin-3-ylethyl)-1H-pyrazine-3-carboxamide
PubChem CID63627861
Molecular FormulaC12H18N4O2
Molecular Weight250.30 g/mol
Exact Mass250.14
IUPAC Name6-oxo-N-(2-piperidin-3-ylethyl)-1H-pyrazine-3-carboxamide
SMILESO=C(NCCC1CCCNC1)c1c[nH]c(=O)cn1
InChIInChI=1S/C12H18N4O2/c17-11-8-15-10(7-16-11)12(18)14-5-3-9-2-1-4-13-6-9/h7-9,13H,1-6H2,(H,14,18)(H,16,17)
InChIKeyFSEUYUOSONDWCJ-UHFFFAOYSA-N
XLogP-0.11
TPSA86.88 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.30
LogP ≤ 5-0.11
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-oxo-N-(2-piperidin-3-ylethyl)-1H-pyrazine-3-carboxamide?
The IUPAC name of 6-oxo-N-(2-piperidin-3-ylethyl)-1H-pyrazine-3-carboxamide (CID 63627861) is 6-oxo-N-(2-piperidin-3-ylethyl)-1H-pyrazine-3-carboxamide.
What is the SMILES notation for 6-oxo-N-(2-piperidin-3-ylethyl)-1H-pyrazine-3-carboxamide?
The canonical SMILES for 6-oxo-N-(2-piperidin-3-ylethyl)-1H-pyrazine-3-carboxamide is O=C(NCCC1CCCNC1)c1c[nH]c(=O)cn1.
What is the InChIKey of 6-oxo-N-(2-piperidin-3-ylethyl)-1H-pyrazine-3-carboxamide?
The InChIKey is FSEUYUOSONDWCJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N4O2/c17-11-8-15-10(7-16-11)12(18)14-5-3-9-2-1-4-13-6-9/h7-9,13H,1-6H2,(H,14,18)(H,16,17).
What are the key properties of 6-oxo-N-(2-piperidin-3-ylethyl)-1H-pyrazine-3-carboxamide?
6-oxo-N-(2-piperidin-3-ylethyl)-1H-pyrazine-3-carboxamide has a molecular weight of 250.30 g/mol, XLogP of -0.11, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-oxo-N-(2-piperidin-3-ylethyl)-1H-pyrazine-3-carboxamide is sourced from PubChem (CID 63627861), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).