3-methyl-N-(6-pyridin-3-yloxypyrazin-2-yl)benzamide

C17H14N4O2 — CID 51037937

IUPAC3-methyl-N-(6-pyridin-3-yloxypyrazin-2-yl)benzamide
SMILESCc1cccc(C(=O)Nc2cncc(Oc3cccnc3)n2)c1
InChIInChI=1S/C17H14N4O2/c1-12-4-2-5-13(8-12)17(22)21-15-10-19-11-16(20-15)23-14-6-3-7-18-9-14/h2-11H,1H3,(H,20,21,22)
InChIKeyWWGVQZDCRGVHMC-UHFFFAOYSA-N
MW306.32 g/mol
LogP3.22
Rot. Bonds4

About 3-methyl-N-(6-pyridin-3-yloxypyrazin-2-yl)benzamide

3-methyl-N-(6-pyridin-3-yloxypyrazin-2-yl)benzamide (PubChem CID 51037937) has the molecular formula C17H14N4O2 and a molecular weight of 306.32 g/mol. Its IUPAC name is 3-methyl-N-(6-pyridin-3-yloxypyrazin-2-yl)benzamide.

Molecular Properties

Compound Name3-methyl-N-(6-pyridin-3-yloxypyrazin-2-yl)benzamide
PubChem CID51037937
Molecular FormulaC17H14N4O2
Molecular Weight306.32 g/mol
Exact Mass306.11
IUPAC Name3-methyl-N-(6-pyridin-3-yloxypyrazin-2-yl)benzamide
SMILESCc1cccc(C(=O)Nc2cncc(Oc3cccnc3)n2)c1
InChIInChI=1S/C17H14N4O2/c1-12-4-2-5-13(8-12)17(22)21-15-10-19-11-16(20-15)23-14-6-3-7-18-9-14/h2-11H,1H3,(H,20,21,22)
InChIKeyWWGVQZDCRGVHMC-UHFFFAOYSA-N
XLogP3.22
TPSA77.00 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.32
LogP ≤ 53.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 3-methyl-N-(6-pyridin-3-yloxypyrazin-2-yl)benzamide?
The IUPAC name of 3-methyl-N-(6-pyridin-3-yloxypyrazin-2-yl)benzamide (CID 51037937) is 3-methyl-N-(6-pyridin-3-yloxypyrazin-2-yl)benzamide.
What is the SMILES notation for 3-methyl-N-(6-pyridin-3-yloxypyrazin-2-yl)benzamide?
The canonical SMILES for 3-methyl-N-(6-pyridin-3-yloxypyrazin-2-yl)benzamide is Cc1cccc(C(=O)Nc2cncc(Oc3cccnc3)n2)c1.
What is the InChIKey of 3-methyl-N-(6-pyridin-3-yloxypyrazin-2-yl)benzamide?
The InChIKey is WWGVQZDCRGVHMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14N4O2/c1-12-4-2-5-13(8-12)17(22)21-15-10-19-11-16(20-15)23-14-6-3-7-18-9-14/h2-11H,1H3,(H,20,21,22).
What are the key properties of 3-methyl-N-(6-pyridin-3-yloxypyrazin-2-yl)benzamide?
3-methyl-N-(6-pyridin-3-yloxypyrazin-2-yl)benzamide has a molecular weight of 306.32 g/mol, XLogP of 3.22, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-N-(6-pyridin-3-yloxypyrazin-2-yl)benzamide is sourced from PubChem (CID 51037937), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).