6-oxo-5-phenyl-1-propylpyrazine-2-carboxamide

C14H15N3O2 — CID 138560300

IUPAC6-oxo-5-phenyl-1-propylpyrazine-2-carboxamide
SMILESCCCn1c(C(N)=O)cnc(-c2ccccc2)c1=O
InChIInChI=1S/C14H15N3O2/c1-2-8-17-11(13(15)18)9-16-12(14(17)19)10-6-4-3-5-7-10/h3-7,9H,2,8H2,1H3,(H2,15,18)
InChIKeyYQTLASYHUKOXNW-UHFFFAOYSA-N
MW257.29 g/mol
LogP1.42
Rot. Bonds4

About 6-oxo-5-phenyl-1-propylpyrazine-2-carboxamide

6-oxo-5-phenyl-1-propylpyrazine-2-carboxamide (PubChem CID 138560300) has the molecular formula C14H15N3O2 and a molecular weight of 257.29 g/mol. Its IUPAC name is 6-oxo-5-phenyl-1-propylpyrazine-2-carboxamide.

Molecular Properties

Compound Name6-oxo-5-phenyl-1-propylpyrazine-2-carboxamide
PubChem CID138560300
Molecular FormulaC14H15N3O2
Molecular Weight257.29 g/mol
Exact Mass257.12
IUPAC Name6-oxo-5-phenyl-1-propylpyrazine-2-carboxamide
SMILESCCCn1c(C(N)=O)cnc(-c2ccccc2)c1=O
InChIInChI=1S/C14H15N3O2/c1-2-8-17-11(13(15)18)9-16-12(14(17)19)10-6-4-3-5-7-10/h3-7,9H,2,8H2,1H3,(H2,15,18)
InChIKeyYQTLASYHUKOXNW-UHFFFAOYSA-N
XLogP1.42
TPSA77.98 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.29
LogP ≤ 51.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-oxo-5-phenyl-1-propylpyrazine-2-carboxamide?
The IUPAC name of 6-oxo-5-phenyl-1-propylpyrazine-2-carboxamide (CID 138560300) is 6-oxo-5-phenyl-1-propylpyrazine-2-carboxamide.
What is the SMILES notation for 6-oxo-5-phenyl-1-propylpyrazine-2-carboxamide?
The canonical SMILES for 6-oxo-5-phenyl-1-propylpyrazine-2-carboxamide is CCCn1c(C(N)=O)cnc(-c2ccccc2)c1=O.
What is the InChIKey of 6-oxo-5-phenyl-1-propylpyrazine-2-carboxamide?
The InChIKey is YQTLASYHUKOXNW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N3O2/c1-2-8-17-11(13(15)18)9-16-12(14(17)19)10-6-4-3-5-7-10/h3-7,9H,2,8H2,1H3,(H2,15,18).
What are the key properties of 6-oxo-5-phenyl-1-propylpyrazine-2-carboxamide?
6-oxo-5-phenyl-1-propylpyrazine-2-carboxamide has a molecular weight of 257.29 g/mol, XLogP of 1.42, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-oxo-5-phenyl-1-propylpyrazine-2-carboxamide is sourced from PubChem (CID 138560300), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).