2-[4-(3-pyridin-3-yloxypyrazin-2-yl)piperidin-1-yl]acetamide

C16H19N5O2 — CID 95822061

IUPAC2-[4-(3-pyridin-3-yloxypyrazin-2-yl)piperidin-1-yl]acetamide
SMILESNC(=O)CN1CCC(c2nccnc2Oc2cccnc2)CC1
InChIInChI=1S/C16H19N5O2/c17-14(22)11-21-8-3-12(4-9-21)15-16(20-7-6-19-15)23-13-2-1-5-18-10-13/h1-2,5-7,10,12H,3-4,8-9,11H2,(H2,17,22)
InChIKeyKKJYVNQLIJEWAV-UHFFFAOYSA-N
MW313.36 g/mol
LogP1.33
Rot. Bonds5

About 2-[4-(3-pyridin-3-yloxypyrazin-2-yl)piperidin-1-yl]acetamide

2-[4-(3-pyridin-3-yloxypyrazin-2-yl)piperidin-1-yl]acetamide (PubChem CID 95822061) has the molecular formula C16H19N5O2 and a molecular weight of 313.36 g/mol. Its IUPAC name is 2-[4-(3-pyridin-3-yloxypyrazin-2-yl)piperidin-1-yl]acetamide.

Molecular Properties

Compound Name2-[4-(3-pyridin-3-yloxypyrazin-2-yl)piperidin-1-yl]acetamide
PubChem CID95822061
Molecular FormulaC16H19N5O2
Molecular Weight313.36 g/mol
Exact Mass313.15
IUPAC Name2-[4-(3-pyridin-3-yloxypyrazin-2-yl)piperidin-1-yl]acetamide
SMILESNC(=O)CN1CCC(c2nccnc2Oc2cccnc2)CC1
InChIInChI=1S/C16H19N5O2/c17-14(22)11-21-8-3-12(4-9-21)15-16(20-7-6-19-15)23-13-2-1-5-18-10-13/h1-2,5-7,10,12H,3-4,8-9,11H2,(H2,17,22)
InChIKeyKKJYVNQLIJEWAV-UHFFFAOYSA-N
XLogP1.33
TPSA94.23 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.36
LogP ≤ 51.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-[4-(3-pyridin-3-yloxypyrazin-2-yl)piperidin-1-yl]acetamide?
The IUPAC name of 2-[4-(3-pyridin-3-yloxypyrazin-2-yl)piperidin-1-yl]acetamide (CID 95822061) is 2-[4-(3-pyridin-3-yloxypyrazin-2-yl)piperidin-1-yl]acetamide.
What is the SMILES notation for 2-[4-(3-pyridin-3-yloxypyrazin-2-yl)piperidin-1-yl]acetamide?
The canonical SMILES for 2-[4-(3-pyridin-3-yloxypyrazin-2-yl)piperidin-1-yl]acetamide is NC(=O)CN1CCC(c2nccnc2Oc2cccnc2)CC1.
What is the InChIKey of 2-[4-(3-pyridin-3-yloxypyrazin-2-yl)piperidin-1-yl]acetamide?
The InChIKey is KKJYVNQLIJEWAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N5O2/c17-14(22)11-21-8-3-12(4-9-21)15-16(20-7-6-19-15)23-13-2-1-5-18-10-13/h1-2,5-7,10,12H,3-4,8-9,11H2,(H2,17,22).
What are the key properties of 2-[4-(3-pyridin-3-yloxypyrazin-2-yl)piperidin-1-yl]acetamide?
2-[4-(3-pyridin-3-yloxypyrazin-2-yl)piperidin-1-yl]acetamide has a molecular weight of 313.36 g/mol, XLogP of 1.33, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(3-pyridin-3-yloxypyrazin-2-yl)piperidin-1-yl]acetamide is sourced from PubChem (CID 95822061), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).