2-[1-(6-phenylmethoxypyrazin-2-yl)piperidin-4-yl]acetamide

C18H22N4O2 — CID 71922425

IUPAC2-[1-(6-phenylmethoxypyrazin-2-yl)piperidin-4-yl]acetamide
SMILESNC(=O)CC1CCN(c2cncc(OCc3ccccc3)n2)CC1
InChIInChI=1S/C18H22N4O2/c19-16(23)10-14-6-8-22(9-7-14)17-11-20-12-18(21-17)24-13-15-4-2-1-3-5-15/h1-5,11-12,14H,6-10,13H2,(H2,19,23)
InChIKeyOEMIYYHWVFTIHL-UHFFFAOYSA-N
MW326.40 g/mol
LogP2.15
Rot. Bonds6

About 2-[1-(6-phenylmethoxypyrazin-2-yl)piperidin-4-yl]acetamide

2-[1-(6-phenylmethoxypyrazin-2-yl)piperidin-4-yl]acetamide (PubChem CID 71922425) has the molecular formula C18H22N4O2 and a molecular weight of 326.40 g/mol. Its IUPAC name is 2-[1-(6-phenylmethoxypyrazin-2-yl)piperidin-4-yl]acetamide.

Molecular Properties

Compound Name2-[1-(6-phenylmethoxypyrazin-2-yl)piperidin-4-yl]acetamide
PubChem CID71922425
Molecular FormulaC18H22N4O2
Molecular Weight326.40 g/mol
Exact Mass326.17
IUPAC Name2-[1-(6-phenylmethoxypyrazin-2-yl)piperidin-4-yl]acetamide
SMILESNC(=O)CC1CCN(c2cncc(OCc3ccccc3)n2)CC1
InChIInChI=1S/C18H22N4O2/c19-16(23)10-14-6-8-22(9-7-14)17-11-20-12-18(21-17)24-13-15-4-2-1-3-5-15/h1-5,11-12,14H,6-10,13H2,(H2,19,23)
InChIKeyOEMIYYHWVFTIHL-UHFFFAOYSA-N
XLogP2.15
TPSA81.34 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.40
LogP ≤ 52.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-[1-(6-phenylmethoxypyrazin-2-yl)piperidin-4-yl]acetamide?
The IUPAC name of 2-[1-(6-phenylmethoxypyrazin-2-yl)piperidin-4-yl]acetamide (CID 71922425) is 2-[1-(6-phenylmethoxypyrazin-2-yl)piperidin-4-yl]acetamide.
What is the SMILES notation for 2-[1-(6-phenylmethoxypyrazin-2-yl)piperidin-4-yl]acetamide?
The canonical SMILES for 2-[1-(6-phenylmethoxypyrazin-2-yl)piperidin-4-yl]acetamide is NC(=O)CC1CCN(c2cncc(OCc3ccccc3)n2)CC1.
What is the InChIKey of 2-[1-(6-phenylmethoxypyrazin-2-yl)piperidin-4-yl]acetamide?
The InChIKey is OEMIYYHWVFTIHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N4O2/c19-16(23)10-14-6-8-22(9-7-14)17-11-20-12-18(21-17)24-13-15-4-2-1-3-5-15/h1-5,11-12,14H,6-10,13H2,(H2,19,23).
What are the key properties of 2-[1-(6-phenylmethoxypyrazin-2-yl)piperidin-4-yl]acetamide?
2-[1-(6-phenylmethoxypyrazin-2-yl)piperidin-4-yl]acetamide has a molecular weight of 326.40 g/mol, XLogP of 2.15, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(6-phenylmethoxypyrazin-2-yl)piperidin-4-yl]acetamide is sourced from PubChem (CID 71922425), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).