N-[5-(5-fluoro-2-pyridinyl)-4-[(6-methoxypyrazin-2-yl)amino]-2-pyridinyl]acetamide

C17H15FN6O2 — CID 170730471

IUPACN-[5-(5-fluoro-2-pyridinyl)-4-[(6-methoxypyrazin-2-yl)amino]-2-pyridinyl]acetamide
SMILESCOc1cncc(Nc2cc(NC(C)=O)ncc2-c2ccc(F)cn2)n1
InChIInChI=1S/C17H15FN6O2/c1-10(25)22-15-5-14(23-16-8-19-9-17(24-16)26-2)12(7-21-15)13-4-3-11(18)6-20-13/h3-9H,1-2H3,(H2,21,22,23,24,25)
InChIKeyNIZLVFYIPVKZOY-UHFFFAOYSA-N
MW354.35 g/mol
LogP2.78
Rot. Bonds5

About N-[5-(5-fluoro-2-pyridinyl)-4-[(6-methoxypyrazin-2-yl)amino]-2-pyridinyl]acetamide

N-[5-(5-fluoro-2-pyridinyl)-4-[(6-methoxypyrazin-2-yl)amino]-2-pyridinyl]acetamide (PubChem CID 170730471) has the molecular formula C17H15FN6O2 and a molecular weight of 354.35 g/mol. Its IUPAC name is N-[5-(5-fluoro-2-pyridinyl)-4-[(6-methoxypyrazin-2-yl)amino]-2-pyridinyl]acetamide.

Molecular Properties

Compound NameN-[5-(5-fluoro-2-pyridinyl)-4-[(6-methoxypyrazin-2-yl)amino]-2-pyridinyl]acetamide
PubChem CID170730471
Molecular FormulaC17H15FN6O2
Molecular Weight354.35 g/mol
Exact Mass354.12
IUPAC NameN-[5-(5-fluoro-2-pyridinyl)-4-[(6-methoxypyrazin-2-yl)amino]-2-pyridinyl]acetamide
SMILESCOc1cncc(Nc2cc(NC(C)=O)ncc2-c2ccc(F)cn2)n1
InChIInChI=1S/C17H15FN6O2/c1-10(25)22-15-5-14(23-16-8-19-9-17(24-16)26-2)12(7-21-15)13-4-3-11(18)6-20-13/h3-9H,1-2H3,(H2,21,22,23,24,25)
InChIKeyNIZLVFYIPVKZOY-UHFFFAOYSA-N
XLogP2.78
TPSA101.92 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.35
LogP ≤ 52.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of N-[5-(5-fluoro-2-pyridinyl)-4-[(6-methoxypyrazin-2-yl)amino]-2-pyridinyl]acetamide?
The IUPAC name of N-[5-(5-fluoro-2-pyridinyl)-4-[(6-methoxypyrazin-2-yl)amino]-2-pyridinyl]acetamide (CID 170730471) is N-[5-(5-fluoro-2-pyridinyl)-4-[(6-methoxypyrazin-2-yl)amino]-2-pyridinyl]acetamide.
What is the SMILES notation for N-[5-(5-fluoro-2-pyridinyl)-4-[(6-methoxypyrazin-2-yl)amino]-2-pyridinyl]acetamide?
The canonical SMILES for N-[5-(5-fluoro-2-pyridinyl)-4-[(6-methoxypyrazin-2-yl)amino]-2-pyridinyl]acetamide is COc1cncc(Nc2cc(NC(C)=O)ncc2-c2ccc(F)cn2)n1.
What is the InChIKey of N-[5-(5-fluoro-2-pyridinyl)-4-[(6-methoxypyrazin-2-yl)amino]-2-pyridinyl]acetamide?
The InChIKey is NIZLVFYIPVKZOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15FN6O2/c1-10(25)22-15-5-14(23-16-8-19-9-17(24-16)26-2)12(7-21-15)13-4-3-11(18)6-20-13/h3-9H,1-2H3,(H2,21,22,23,24,25).
What are the key properties of N-[5-(5-fluoro-2-pyridinyl)-4-[(6-methoxypyrazin-2-yl)amino]-2-pyridinyl]acetamide?
N-[5-(5-fluoro-2-pyridinyl)-4-[(6-methoxypyrazin-2-yl)amino]-2-pyridinyl]acetamide has a molecular weight of 354.35 g/mol, XLogP of 2.78, 5 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-(5-fluoro-2-pyridinyl)-4-[(6-methoxypyrazin-2-yl)amino]-2-pyridinyl]acetamide is sourced from PubChem (CID 170730471), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).