1-oxo-N-pyridin-3-yl-3,4-dihydro-2H-pyrrolo[1,2-a]pyrazine-8-carboxamide

C13H12N4O2 — CID 134463470

IUPAC1-oxo-N-pyridin-3-yl-3,4-dihydro-2H-pyrrolo[1,2-a]pyrazine-8-carboxamide
SMILESO=C(Nc1cccnc1)c1ccn2c1C(=O)NCC2
InChIInChI=1S/C13H12N4O2/c18-12(16-9-2-1-4-14-8-9)10-3-6-17-7-5-15-13(19)11(10)17/h1-4,6,8H,5,7H2,(H,15,19)(H,16,18)
InChIKeyULXYQYSNHIYHDM-UHFFFAOYSA-N
MW256.26 g/mol
LogP0.88
Rot. Bonds2

About 1-oxo-N-pyridin-3-yl-3,4-dihydro-2H-pyrrolo[1,2-a]pyrazine-8-carboxamide

1-oxo-N-pyridin-3-yl-3,4-dihydro-2H-pyrrolo[1,2-a]pyrazine-8-carboxamide (PubChem CID 134463470) has the molecular formula C13H12N4O2 and a molecular weight of 256.26 g/mol. Its IUPAC name is 1-oxo-N-pyridin-3-yl-3,4-dihydro-2H-pyrrolo[1,2-a]pyrazine-8-carboxamide.

Molecular Properties

Compound Name1-oxo-N-pyridin-3-yl-3,4-dihydro-2H-pyrrolo[1,2-a]pyrazine-8-carboxamide
PubChem CID134463470
Molecular FormulaC13H12N4O2
Molecular Weight256.26 g/mol
Exact Mass256.10
IUPAC Name1-oxo-N-pyridin-3-yl-3,4-dihydro-2H-pyrrolo[1,2-a]pyrazine-8-carboxamide
SMILESO=C(Nc1cccnc1)c1ccn2c1C(=O)NCC2
InChIInChI=1S/C13H12N4O2/c18-12(16-9-2-1-4-14-8-9)10-3-6-17-7-5-15-13(19)11(10)17/h1-4,6,8H,5,7H2,(H,15,19)(H,16,18)
InChIKeyULXYQYSNHIYHDM-UHFFFAOYSA-N
XLogP0.88
TPSA76.02 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.26
LogP ≤ 50.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(5-chlorothiophen-2-yl)-1-oxo-N-pyridin-3-yl-3,4-dihydropyrrolo[1,2-a]pyrazine-8-carboxamide
CID 134463399
1-methyl-5-(piperazin-1-ylmethyl)-N-pyridin-3-ylpyrazole-4-carboxamide
CID 83580921
4-oxo-N-pyridin-3-yl-5,6,7,8-tetrahydro-1H-cyclohepta[b]pyrrole-3-carboxamide
CID 18696540
2,5-dihydroxy-N-pyridin-3-ylbenzamide
CID 113347059
N-pyridin-3-yl-1H-indole-3-carboxamide
CID 43399328
N-pyridin-3-yl-1,2,3,4-tetrahydroisoquinoline-5-carboxamide
CID 104557847
2-chloro-5-hydroxy-N-pyridin-3-ylbenzamide
CID 106501191
4-oxo-N-pyridin-3-yl-3,7-dihydropyrrolo[2,3-d]pyrimidine-5-carboxamide
CID 167853656
4-hydroxy-N-pyridin-3-ylbenzamide
CID 15965764
2-benzamido-N-pyridin-3-ylbenzamide
CID 730923
4,5-dimethyl-N-pyridin-3-ylpyridine-3-carboxamide;molecular hydrogen
CID 144555172
5-oxo-N-pyridin-3-yl-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide
CID 4606085

Frequently Asked Questions

What is the IUPAC name of 1-oxo-N-pyridin-3-yl-3,4-dihydro-2H-pyrrolo[1,2-a]pyrazine-8-carboxamide?
The IUPAC name of 1-oxo-N-pyridin-3-yl-3,4-dihydro-2H-pyrrolo[1,2-a]pyrazine-8-carboxamide (CID 134463470) is 1-oxo-N-pyridin-3-yl-3,4-dihydro-2H-pyrrolo[1,2-a]pyrazine-8-carboxamide.
What is the SMILES notation for 1-oxo-N-pyridin-3-yl-3,4-dihydro-2H-pyrrolo[1,2-a]pyrazine-8-carboxamide?
The canonical SMILES for 1-oxo-N-pyridin-3-yl-3,4-dihydro-2H-pyrrolo[1,2-a]pyrazine-8-carboxamide is O=C(Nc1cccnc1)c1ccn2c1C(=O)NCC2.
What is the InChIKey of 1-oxo-N-pyridin-3-yl-3,4-dihydro-2H-pyrrolo[1,2-a]pyrazine-8-carboxamide?
The InChIKey is ULXYQYSNHIYHDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12N4O2/c18-12(16-9-2-1-4-14-8-9)10-3-6-17-7-5-15-13(19)11(10)17/h1-4,6,8H,5,7H2,(H,15,19)(H,16,18).
What are the key properties of 1-oxo-N-pyridin-3-yl-3,4-dihydro-2H-pyrrolo[1,2-a]pyrazine-8-carboxamide?
1-oxo-N-pyridin-3-yl-3,4-dihydro-2H-pyrrolo[1,2-a]pyrazine-8-carboxamide has a molecular weight of 256.26 g/mol, XLogP of 0.88, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-oxo-N-pyridin-3-yl-3,4-dihydro-2H-pyrrolo[1,2-a]pyrazine-8-carboxamide is sourced from PubChem (CID 134463470), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).