N-[2-(4-oxo-3,1-benzoxazin-2-yl)phenyl]pyrazine-2-carboxamide

C19H12N4O3 — CID 143844190

IUPACN-[2-(4-oxo-3,1-benzoxazin-2-yl)phenyl]pyrazine-2-carboxamide
SMILESO=C(Nc1ccccc1-c1nc2ccccc2c(=O)o1)c1cnccn1
InChIInChI=1S/C19H12N4O3/c24-17(16-11-20-9-10-21-16)22-14-7-3-1-5-12(14)18-23-15-8-4-2-6-13(15)19(25)26-18/h1-11H,(H,22,24)
InChIKeyZLIFUGCHGFMFTK-UHFFFAOYSA-N
MW344.33 g/mol
LogP2.90
Rot. Bonds3

About N-[2-(4-oxo-3,1-benzoxazin-2-yl)phenyl]pyrazine-2-carboxamide

N-[2-(4-oxo-3,1-benzoxazin-2-yl)phenyl]pyrazine-2-carboxamide (PubChem CID 143844190) has the molecular formula C19H12N4O3 and a molecular weight of 344.33 g/mol. Its IUPAC name is N-[2-(4-oxo-3,1-benzoxazin-2-yl)phenyl]pyrazine-2-carboxamide.

Molecular Properties

Compound NameN-[2-(4-oxo-3,1-benzoxazin-2-yl)phenyl]pyrazine-2-carboxamide
PubChem CID143844190
Molecular FormulaC19H12N4O3
Molecular Weight344.33 g/mol
Exact Mass344.09
IUPAC NameN-[2-(4-oxo-3,1-benzoxazin-2-yl)phenyl]pyrazine-2-carboxamide
SMILESO=C(Nc1ccccc1-c1nc2ccccc2c(=O)o1)c1cnccn1
InChIInChI=1S/C19H12N4O3/c24-17(16-11-20-9-10-21-16)22-14-7-3-1-5-12(14)18-23-15-8-4-2-6-13(15)19(25)26-18/h1-11H,(H,22,24)
InChIKeyZLIFUGCHGFMFTK-UHFFFAOYSA-N
XLogP2.90
TPSA97.98 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.33
LogP ≤ 52.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

2,2,2-trifluoro-N-[2-(4-oxo-3,1-benzoxazin-2-yl)phenyl]acetamide
CID 825300
9,10-dioxo-N-[2-(4-oxo-3,1-benzoxazin-2-yl)phenyl]anthracene-2-carboxamide
CID 143844115
2-methoxy-N-[2-(4-oxo-3,1-benzoxazin-2-yl)phenyl]benzamide
CID 143844116
molecular hydrogen;N-[2-(4-oxo-3,1-benzoxazin-2-yl)phenyl]-3-phenylbenzamide
CID 143844150
N-[2-(6-oxo-1H-pyridazin-3-yl)phenyl]pyrazine-2-carboxamide
CID 71804997
N-[2-(2,4-dimethyl-1,3-thiazol-5-yl)-4-oxo-3,1-benzoxazin-8-yl]pyrazine-2-carboxamide
CID 58552812
1-(3-chlorophenyl)-3-[2-(4-oxo-3,1-benzoxazin-2-yl)phenyl]urea
CID 58616063
[3-[[2-(4-oxo-3,1-benzoxazin-2-yl)phenyl]carbamoyl]naphthalen-2-yl] acetate
CID 143844163
N-(2-sulfanylphenyl)pyrazine-2-carboxamide
CID 136757506
1-(3-methoxyphenyl)-3-[2-(4-oxo-3,1-benzoxazin-2-yl)phenyl]urea
CID 58616068
1-(4-ethoxyphenyl)-3-[2-(4-oxo-3,1-benzoxazin-2-yl)phenyl]urea
CID 58616073
N-(2-imidazo[1,2-a]pyridin-2-ylphenyl)pyrazine-2-carboxamide
CID 121148969

Frequently Asked Questions

What is the IUPAC name of N-[2-(4-oxo-3,1-benzoxazin-2-yl)phenyl]pyrazine-2-carboxamide?
The IUPAC name of N-[2-(4-oxo-3,1-benzoxazin-2-yl)phenyl]pyrazine-2-carboxamide (CID 143844190) is N-[2-(4-oxo-3,1-benzoxazin-2-yl)phenyl]pyrazine-2-carboxamide.
What is the SMILES notation for N-[2-(4-oxo-3,1-benzoxazin-2-yl)phenyl]pyrazine-2-carboxamide?
The canonical SMILES for N-[2-(4-oxo-3,1-benzoxazin-2-yl)phenyl]pyrazine-2-carboxamide is O=C(Nc1ccccc1-c1nc2ccccc2c(=O)o1)c1cnccn1.
What is the InChIKey of N-[2-(4-oxo-3,1-benzoxazin-2-yl)phenyl]pyrazine-2-carboxamide?
The InChIKey is ZLIFUGCHGFMFTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H12N4O3/c24-17(16-11-20-9-10-21-16)22-14-7-3-1-5-12(14)18-23-15-8-4-2-6-13(15)19(25)26-18/h1-11H,(H,22,24).
What are the key properties of N-[2-(4-oxo-3,1-benzoxazin-2-yl)phenyl]pyrazine-2-carboxamide?
N-[2-(4-oxo-3,1-benzoxazin-2-yl)phenyl]pyrazine-2-carboxamide has a molecular weight of 344.33 g/mol, XLogP of 2.90, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-oxo-3,1-benzoxazin-2-yl)phenyl]pyrazine-2-carboxamide is sourced from PubChem (CID 143844190), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).