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

C12H18N4O2 — CID 54923776

IUPACN-ethyl-6-oxo-N-piperidin-4-yl-1H-pyrazine-3-carboxamide
SMILESCCN(C(=O)c1c[nH]c(=O)cn1)C1CCNCC1
InChIInChI=1S/C12H18N4O2/c1-2-16(9-3-5-13-6-4-9)12(18)10-7-15-11(17)8-14-10/h7-9,13H,2-6H2,1H3,(H,15,17)
InChIKeyMIUJSEDKKMCHAO-UHFFFAOYSA-N
MW250.30 g/mol
LogP-0.02
Rot. Bonds3

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

N-ethyl-6-oxo-N-piperidin-4-yl-1H-pyrazine-3-carboxamide (PubChem CID 54923776) has the molecular formula C12H18N4O2 and a molecular weight of 250.30 g/mol. Its IUPAC name is N-ethyl-6-oxo-N-piperidin-4-yl-1H-pyrazine-3-carboxamide.

Molecular Properties

Compound NameN-ethyl-6-oxo-N-piperidin-4-yl-1H-pyrazine-3-carboxamide
PubChem CID54923776
Molecular FormulaC12H18N4O2
Molecular Weight250.30 g/mol
Exact Mass250.14
IUPAC NameN-ethyl-6-oxo-N-piperidin-4-yl-1H-pyrazine-3-carboxamide
SMILESCCN(C(=O)c1c[nH]c(=O)cn1)C1CCNCC1
InChIInChI=1S/C12H18N4O2/c1-2-16(9-3-5-13-6-4-9)12(18)10-7-15-11(17)8-14-10/h7-9,13H,2-6H2,1H3,(H,15,17)
InChIKeyMIUJSEDKKMCHAO-UHFFFAOYSA-N
XLogP-0.02
TPSA78.09 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.30
LogP ≤ 5-0.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

5-[(2S)-2-butyl-4-methyl-3-oxopiperazine-1-carbonyl]-1H-pyrazin-2-one
CID 96397909
6-[(4-Ethyl-3,3-dimethylpiperazin-1-yl)carbonyl]pyrazin-2-ol
CID 124209694
5-[(1,9-Dimethyl-1,4,9-triazaspiro[5.5]undec-4-yl)carbonyl]pyrazin-2-ol
CID 56755901
N-[2-[4-(1,2-dihydropyrazine-5-carbonyl)piperazin-1-yl]ethyl]acetamide
CID 70289449
1,5-Dimethylpiperazin-2-one;1,5-dimethylpyrazin-2-one
CID 159910237
(E)-3-amino-4-ethylimino-2-(methylamino)-N-(1-methylpiperidin-4-yl)but-2-enamide
CID 166914984
5-(piperazine-1-carbonyl)-1H-pyrazin-2-one
CID 28788615
6-oxo-N-piperidin-4-yl-1H-pyrazine-3-carboxamide
CID 43167653
6-oxo-N-(3-piperazin-1-ylpropyl)-1H-pyrazine-3-carboxamide
CID 43443306
5-(4-aminopiperidine-1-carbonyl)-1H-pyrazin-2-one
CID 43556262
N-(3-azabicyclo[3.1.0]hexan-6-yl)-6-oxo-1H-pyrazine-3-carboxamide
CID 43594248
N-(3-aminocyclobutyl)-6-oxo-1H-pyrazine-3-carboxamide
CID 43594837

Frequently Asked Questions

What is the IUPAC name of N-ethyl-6-oxo-N-piperidin-4-yl-1H-pyrazine-3-carboxamide?
The IUPAC name of N-ethyl-6-oxo-N-piperidin-4-yl-1H-pyrazine-3-carboxamide (CID 54923776) is N-ethyl-6-oxo-N-piperidin-4-yl-1H-pyrazine-3-carboxamide.
What is the SMILES notation for N-ethyl-6-oxo-N-piperidin-4-yl-1H-pyrazine-3-carboxamide?
The canonical SMILES for N-ethyl-6-oxo-N-piperidin-4-yl-1H-pyrazine-3-carboxamide is CCN(C(=O)c1c[nH]c(=O)cn1)C1CCNCC1.
What is the InChIKey of N-ethyl-6-oxo-N-piperidin-4-yl-1H-pyrazine-3-carboxamide?
The InChIKey is MIUJSEDKKMCHAO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N4O2/c1-2-16(9-3-5-13-6-4-9)12(18)10-7-15-11(17)8-14-10/h7-9,13H,2-6H2,1H3,(H,15,17).
What are the key properties of N-ethyl-6-oxo-N-piperidin-4-yl-1H-pyrazine-3-carboxamide?
N-ethyl-6-oxo-N-piperidin-4-yl-1H-pyrazine-3-carboxamide has a molecular weight of 250.30 g/mol, XLogP of -0.02, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-6-oxo-N-piperidin-4-yl-1H-pyrazine-3-carboxamide is sourced from PubChem (CID 54923776), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).