2-(3-methoxy-5-pyrazin-2-yl-2-pyridinyl)acetamide

C12H12N4O2 — CID 121273558

IUPAC2-(3-methoxy-5-pyrazin-2-yl-2-pyridinyl)acetamide
SMILESCOc1cc(-c2cnccn2)cnc1CC(N)=O
InChIInChI=1S/C12H12N4O2/c1-18-11-4-8(10-7-14-2-3-15-10)6-16-9(11)5-12(13)17/h2-4,6-7H,5H2,1H3,(H2,13,17)
InChIKeyCJUIEWDPGOHREU-UHFFFAOYSA-N
MW244.25 g/mol
LogP0.57
Rot. Bonds4

About 2-(3-methoxy-5-pyrazin-2-yl-2-pyridinyl)acetamide

2-(3-methoxy-5-pyrazin-2-yl-2-pyridinyl)acetamide (PubChem CID 121273558) has the molecular formula C12H12N4O2 and a molecular weight of 244.25 g/mol. Its IUPAC name is 2-(3-methoxy-5-pyrazin-2-yl-2-pyridinyl)acetamide.

Molecular Properties

Compound Name2-(3-methoxy-5-pyrazin-2-yl-2-pyridinyl)acetamide
PubChem CID121273558
Molecular FormulaC12H12N4O2
Molecular Weight244.25 g/mol
Exact Mass244.10
IUPAC Name2-(3-methoxy-5-pyrazin-2-yl-2-pyridinyl)acetamide
SMILESCOc1cc(-c2cnccn2)cnc1CC(N)=O
InChIInChI=1S/C12H12N4O2/c1-18-11-4-8(10-7-14-2-3-15-10)6-16-9(11)5-12(13)17/h2-4,6-7H,5H2,1H3,(H2,13,17)
InChIKeyCJUIEWDPGOHREU-UHFFFAOYSA-N
XLogP0.57
TPSA90.99 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.25
LogP ≤ 50.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(3-methoxy-5-pyrazin-2-yl-2-pyridinyl)acetamide?
The IUPAC name of 2-(3-methoxy-5-pyrazin-2-yl-2-pyridinyl)acetamide (CID 121273558) is 2-(3-methoxy-5-pyrazin-2-yl-2-pyridinyl)acetamide.
What is the SMILES notation for 2-(3-methoxy-5-pyrazin-2-yl-2-pyridinyl)acetamide?
The canonical SMILES for 2-(3-methoxy-5-pyrazin-2-yl-2-pyridinyl)acetamide is COc1cc(-c2cnccn2)cnc1CC(N)=O.
What is the InChIKey of 2-(3-methoxy-5-pyrazin-2-yl-2-pyridinyl)acetamide?
The InChIKey is CJUIEWDPGOHREU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12N4O2/c1-18-11-4-8(10-7-14-2-3-15-10)6-16-9(11)5-12(13)17/h2-4,6-7H,5H2,1H3,(H2,13,17).
What are the key properties of 2-(3-methoxy-5-pyrazin-2-yl-2-pyridinyl)acetamide?
2-(3-methoxy-5-pyrazin-2-yl-2-pyridinyl)acetamide has a molecular weight of 244.25 g/mol, XLogP of 0.57, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methoxy-5-pyrazin-2-yl-2-pyridinyl)acetamide is sourced from PubChem (CID 121273558), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).