1-(4-pyrazin-2-ylpiperazin-1-yl)propan-2-ol

C11H18N4O — CID 57482595

IUPAC1-(4-pyrazin-2-ylpiperazin-1-yl)propan-2-ol
SMILESCC(O)CN1CCN(c2cnccn2)CC1
InChIInChI=1S/C11H18N4O/c1-10(16)9-14-4-6-15(7-5-14)11-8-12-2-3-13-11/h2-3,8,10,16H,4-7,9H2,1H3
InChIKeyBEUFMGXZZLOQQS-UHFFFAOYSA-N
MW222.29 g/mol
LogP-0.02
Rot. Bonds3

About 1-(4-pyrazin-2-ylpiperazin-1-yl)propan-2-ol

1-(4-pyrazin-2-ylpiperazin-1-yl)propan-2-ol (PubChem CID 57482595) has the molecular formula C11H18N4O and a molecular weight of 222.29 g/mol. Its IUPAC name is 1-(4-pyrazin-2-ylpiperazin-1-yl)propan-2-ol.

Molecular Properties

Compound Name1-(4-pyrazin-2-ylpiperazin-1-yl)propan-2-ol
PubChem CID57482595
Molecular FormulaC11H18N4O
Molecular Weight222.29 g/mol
Exact Mass222.15
IUPAC Name1-(4-pyrazin-2-ylpiperazin-1-yl)propan-2-ol
SMILESCC(O)CN1CCN(c2cnccn2)CC1
InChIInChI=1S/C11H18N4O/c1-10(16)9-14-4-6-15(7-5-14)11-8-12-2-3-13-11/h2-3,8,10,16H,4-7,9H2,1H3
InChIKeyBEUFMGXZZLOQQS-UHFFFAOYSA-N
XLogP-0.02
TPSA52.49 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.29
LogP ≤ 5-0.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-(4-pyrazin-2-ylpiperazin-1-yl)propan-2-ol?
The IUPAC name of 1-(4-pyrazin-2-ylpiperazin-1-yl)propan-2-ol (CID 57482595) is 1-(4-pyrazin-2-ylpiperazin-1-yl)propan-2-ol.
What is the SMILES notation for 1-(4-pyrazin-2-ylpiperazin-1-yl)propan-2-ol?
The canonical SMILES for 1-(4-pyrazin-2-ylpiperazin-1-yl)propan-2-ol is CC(O)CN1CCN(c2cnccn2)CC1.
What is the InChIKey of 1-(4-pyrazin-2-ylpiperazin-1-yl)propan-2-ol?
The InChIKey is BEUFMGXZZLOQQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4O/c1-10(16)9-14-4-6-15(7-5-14)11-8-12-2-3-13-11/h2-3,8,10,16H,4-7,9H2,1H3.
What are the key properties of 1-(4-pyrazin-2-ylpiperazin-1-yl)propan-2-ol?
1-(4-pyrazin-2-ylpiperazin-1-yl)propan-2-ol has a molecular weight of 222.29 g/mol, XLogP of -0.02, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-pyrazin-2-ylpiperazin-1-yl)propan-2-ol is sourced from PubChem (CID 57482595), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).