2-(5,6-dimethyl-2-pyrazin-2-ylpyrimidin-4-yl)oxy-N-(2-methoxyphenyl)acetamide

C19H19N5O3 — CID 95922351

IUPAC2-(5,6-dimethyl-2-pyrazin-2-ylpyrimidin-4-yl)oxy-N-(2-methoxyphenyl)acetamide
SMILESCOc1ccccc1NC(=O)COc1nc(-c2cnccn2)nc(C)c1C
InChIInChI=1S/C19H19N5O3/c1-12-13(2)22-18(15-10-20-8-9-21-15)24-19(12)27-11-17(25)23-14-6-4-5-7-16(14)26-3/h4-10H,11H2,1-3H3,(H,23,25)
InChIKeyDBLPSGPRWBNAQW-UHFFFAOYSA-N
MW365.39 g/mol
LogP2.58
Rot. Bonds6

About 2-(5,6-dimethyl-2-pyrazin-2-ylpyrimidin-4-yl)oxy-N-(2-methoxyphenyl)acetamide

2-(5,6-dimethyl-2-pyrazin-2-ylpyrimidin-4-yl)oxy-N-(2-methoxyphenyl)acetamide (PubChem CID 95922351) has the molecular formula C19H19N5O3 and a molecular weight of 365.39 g/mol. Its IUPAC name is 2-(5,6-dimethyl-2-pyrazin-2-ylpyrimidin-4-yl)oxy-N-(2-methoxyphenyl)acetamide.

Molecular Properties

Compound Name2-(5,6-dimethyl-2-pyrazin-2-ylpyrimidin-4-yl)oxy-N-(2-methoxyphenyl)acetamide
PubChem CID95922351
Molecular FormulaC19H19N5O3
Molecular Weight365.39 g/mol
Exact Mass365.15
IUPAC Name2-(5,6-dimethyl-2-pyrazin-2-ylpyrimidin-4-yl)oxy-N-(2-methoxyphenyl)acetamide
SMILESCOc1ccccc1NC(=O)COc1nc(-c2cnccn2)nc(C)c1C
InChIInChI=1S/C19H19N5O3/c1-12-13(2)22-18(15-10-20-8-9-21-15)24-19(12)27-11-17(25)23-14-6-4-5-7-16(14)26-3/h4-10H,11H2,1-3H3,(H,23,25)
InChIKeyDBLPSGPRWBNAQW-UHFFFAOYSA-N
XLogP2.58
TPSA99.12 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms27
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.39
LogP ≤ 52.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 2-(5,6-dimethyl-2-pyrazin-2-ylpyrimidin-4-yl)oxy-N-(2-methoxyphenyl)acetamide?
The IUPAC name of 2-(5,6-dimethyl-2-pyrazin-2-ylpyrimidin-4-yl)oxy-N-(2-methoxyphenyl)acetamide (CID 95922351) is 2-(5,6-dimethyl-2-pyrazin-2-ylpyrimidin-4-yl)oxy-N-(2-methoxyphenyl)acetamide.
What is the SMILES notation for 2-(5,6-dimethyl-2-pyrazin-2-ylpyrimidin-4-yl)oxy-N-(2-methoxyphenyl)acetamide?
The canonical SMILES for 2-(5,6-dimethyl-2-pyrazin-2-ylpyrimidin-4-yl)oxy-N-(2-methoxyphenyl)acetamide is COc1ccccc1NC(=O)COc1nc(-c2cnccn2)nc(C)c1C.
What is the InChIKey of 2-(5,6-dimethyl-2-pyrazin-2-ylpyrimidin-4-yl)oxy-N-(2-methoxyphenyl)acetamide?
The InChIKey is DBLPSGPRWBNAQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N5O3/c1-12-13(2)22-18(15-10-20-8-9-21-15)24-19(12)27-11-17(25)23-14-6-4-5-7-16(14)26-3/h4-10H,11H2,1-3H3,(H,23,25).
What are the key properties of 2-(5,6-dimethyl-2-pyrazin-2-ylpyrimidin-4-yl)oxy-N-(2-methoxyphenyl)acetamide?
2-(5,6-dimethyl-2-pyrazin-2-ylpyrimidin-4-yl)oxy-N-(2-methoxyphenyl)acetamide has a molecular weight of 365.39 g/mol, XLogP of 2.58, 6 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5,6-dimethyl-2-pyrazin-2-ylpyrimidin-4-yl)oxy-N-(2-methoxyphenyl)acetamide is sourced from PubChem (CID 95922351), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).