2-[4-(6-ethoxypyrazin-2-yl)piperazin-1-yl]phenol

C16H20N4O2 — CID 75383880

IUPAC2-[4-(6-ethoxypyrazin-2-yl)piperazin-1-yl]phenol
SMILESCCOc1cncc(N2CCN(c3ccccc3O)CC2)n1
InChIInChI=1S/C16H20N4O2/c1-2-22-16-12-17-11-15(18-16)20-9-7-19(8-10-20)13-5-3-4-6-14(13)21/h3-6,11-12,21H,2,7-10H2,1H3
InChIKeyYYBZMSHATNDXAZ-UHFFFAOYSA-N
MW300.36 g/mol
LogP1.91
Rot. Bonds4

About 2-[4-(6-ethoxypyrazin-2-yl)piperazin-1-yl]phenol

2-[4-(6-ethoxypyrazin-2-yl)piperazin-1-yl]phenol (PubChem CID 75383880) has the molecular formula C16H20N4O2 and a molecular weight of 300.36 g/mol. Its IUPAC name is 2-[4-(6-ethoxypyrazin-2-yl)piperazin-1-yl]phenol.

Molecular Properties

Compound Name2-[4-(6-ethoxypyrazin-2-yl)piperazin-1-yl]phenol
PubChem CID75383880
Molecular FormulaC16H20N4O2
Molecular Weight300.36 g/mol
Exact Mass300.16
IUPAC Name2-[4-(6-ethoxypyrazin-2-yl)piperazin-1-yl]phenol
SMILESCCOc1cncc(N2CCN(c3ccccc3O)CC2)n1
InChIInChI=1S/C16H20N4O2/c1-2-22-16-12-17-11-15(18-16)20-9-7-19(8-10-20)13-5-3-4-6-14(13)21/h3-6,11-12,21H,2,7-10H2,1H3
InChIKeyYYBZMSHATNDXAZ-UHFFFAOYSA-N
XLogP1.91
TPSA61.72 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.36
LogP ≤ 51.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-[4-(6-ethoxypyrazin-2-yl)piperazin-1-yl]phenol?
The IUPAC name of 2-[4-(6-ethoxypyrazin-2-yl)piperazin-1-yl]phenol (CID 75383880) is 2-[4-(6-ethoxypyrazin-2-yl)piperazin-1-yl]phenol.
What is the SMILES notation for 2-[4-(6-ethoxypyrazin-2-yl)piperazin-1-yl]phenol?
The canonical SMILES for 2-[4-(6-ethoxypyrazin-2-yl)piperazin-1-yl]phenol is CCOc1cncc(N2CCN(c3ccccc3O)CC2)n1.
What is the InChIKey of 2-[4-(6-ethoxypyrazin-2-yl)piperazin-1-yl]phenol?
The InChIKey is YYBZMSHATNDXAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N4O2/c1-2-22-16-12-17-11-15(18-16)20-9-7-19(8-10-20)13-5-3-4-6-14(13)21/h3-6,11-12,21H,2,7-10H2,1H3.
What are the key properties of 2-[4-(6-ethoxypyrazin-2-yl)piperazin-1-yl]phenol?
2-[4-(6-ethoxypyrazin-2-yl)piperazin-1-yl]phenol has a molecular weight of 300.36 g/mol, XLogP of 1.91, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(6-ethoxypyrazin-2-yl)piperazin-1-yl]phenol is sourced from PubChem (CID 75383880), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).