[1-(3-piperazin-1-ylpyrazin-2-yl)piperidin-4-yl]methanol

C14H23N5O — CID 59438242

IUPAC[1-(3-piperazin-1-ylpyrazin-2-yl)piperidin-4-yl]methanol
SMILESOCC1CCN(c2nccnc2N2CCNCC2)CC1
InChIInChI=1S/C14H23N5O/c20-11-12-1-7-18(8-2-12)13-14(17-4-3-16-13)19-9-5-15-6-10-19/h3-4,12,15,20H,1-2,5-11H2
InChIKeyLHXKVJAGHAUQDV-UHFFFAOYSA-N
MW277.37 g/mol
LogP0.09
Rot. Bonds3

About [1-(3-piperazin-1-ylpyrazin-2-yl)piperidin-4-yl]methanol

[1-(3-piperazin-1-ylpyrazin-2-yl)piperidin-4-yl]methanol (PubChem CID 59438242) has the molecular formula C14H23N5O and a molecular weight of 277.37 g/mol. Its IUPAC name is [1-(3-piperazin-1-ylpyrazin-2-yl)piperidin-4-yl]methanol.

Molecular Properties

Compound Name[1-(3-piperazin-1-ylpyrazin-2-yl)piperidin-4-yl]methanol
PubChem CID59438242
Molecular FormulaC14H23N5O
Molecular Weight277.37 g/mol
Exact Mass277.19
IUPAC Name[1-(3-piperazin-1-ylpyrazin-2-yl)piperidin-4-yl]methanol
SMILESOCC1CCN(c2nccnc2N2CCNCC2)CC1
InChIInChI=1S/C14H23N5O/c20-11-12-1-7-18(8-2-12)13-14(17-4-3-16-13)19-9-5-15-6-10-19/h3-4,12,15,20H,1-2,5-11H2
InChIKeyLHXKVJAGHAUQDV-UHFFFAOYSA-N
XLogP0.09
TPSA64.52 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.37
LogP ≤ 50.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of [1-(3-piperazin-1-ylpyrazin-2-yl)piperidin-4-yl]methanol?
The IUPAC name of [1-(3-piperazin-1-ylpyrazin-2-yl)piperidin-4-yl]methanol (CID 59438242) is [1-(3-piperazin-1-ylpyrazin-2-yl)piperidin-4-yl]methanol.
What is the SMILES notation for [1-(3-piperazin-1-ylpyrazin-2-yl)piperidin-4-yl]methanol?
The canonical SMILES for [1-(3-piperazin-1-ylpyrazin-2-yl)piperidin-4-yl]methanol is OCC1CCN(c2nccnc2N2CCNCC2)CC1.
What is the InChIKey of [1-(3-piperazin-1-ylpyrazin-2-yl)piperidin-4-yl]methanol?
The InChIKey is LHXKVJAGHAUQDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N5O/c20-11-12-1-7-18(8-2-12)13-14(17-4-3-16-13)19-9-5-15-6-10-19/h3-4,12,15,20H,1-2,5-11H2.
What are the key properties of [1-(3-piperazin-1-ylpyrazin-2-yl)piperidin-4-yl]methanol?
[1-(3-piperazin-1-ylpyrazin-2-yl)piperidin-4-yl]methanol has a molecular weight of 277.37 g/mol, XLogP of 0.09, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(3-piperazin-1-ylpyrazin-2-yl)piperidin-4-yl]methanol is sourced from PubChem (CID 59438242), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).