[1-[5-(hydroxymethyl)pyrazin-2-yl]piperidin-3-yl]methanol

C11H17N3O2 — CID 107372633

IUPAC[1-[5-(hydroxymethyl)pyrazin-2-yl]piperidin-3-yl]methanol
SMILESOCc1cnc(N2CCCC(CO)C2)cn1
InChIInChI=1S/C11H17N3O2/c15-7-9-2-1-3-14(6-9)11-5-12-10(8-16)4-13-11/h4-5,9,15-16H,1-3,6-8H2
InChIKeyXBYAOIOSIGMDAC-UHFFFAOYSA-N
MW223.28 g/mol
LogP0.18
Rot. Bonds3

About [1-[5-(hydroxymethyl)pyrazin-2-yl]piperidin-3-yl]methanol

[1-[5-(hydroxymethyl)pyrazin-2-yl]piperidin-3-yl]methanol (PubChem CID 107372633) has the molecular formula C11H17N3O2 and a molecular weight of 223.28 g/mol. Its IUPAC name is [1-[5-(hydroxymethyl)pyrazin-2-yl]piperidin-3-yl]methanol.

Molecular Properties

Compound Name[1-[5-(hydroxymethyl)pyrazin-2-yl]piperidin-3-yl]methanol
PubChem CID107372633
Molecular FormulaC11H17N3O2
Molecular Weight223.28 g/mol
Exact Mass223.13
IUPAC Name[1-[5-(hydroxymethyl)pyrazin-2-yl]piperidin-3-yl]methanol
SMILESOCc1cnc(N2CCCC(CO)C2)cn1
InChIInChI=1S/C11H17N3O2/c15-7-9-2-1-3-14(6-9)11-5-12-10(8-16)4-13-11/h4-5,9,15-16H,1-3,6-8H2
InChIKeyXBYAOIOSIGMDAC-UHFFFAOYSA-N
XLogP0.18
TPSA69.48 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.28
LogP ≤ 50.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

[(3S)-1-quinoxalin-2-ylpiperidin-3-yl]methanol
CID 33370711
[1-(5-amino-4-methyl-2-pyridinyl)piperidin-3-yl]methanol
CID 79172728
[1-[6-ethyl-4-(hydroxymethyl)-2-pyridinyl]piperidin-3-yl]methanol
CID 113380422
[5-(4-piperidin-1-ylpiperidin-1-yl)pyrazin-2-yl]methanol
CID 107372731
N-[[5-(3-ethylpiperidin-1-yl)pyrazin-2-yl]methyl]-2-methylpropan-2-amine
CID 107379243
[1-(5-nitro-2-pyridinyl)piperidin-3-yl]methanol
CID 2859766
N'-hydroxy-6-[3-(hydroxymethyl)piperidin-1-yl]pyridine-3-carboximidamide
CID 43590323
[5-(3,6-dihydro-2H-pyridin-1-yl)pyrazin-2-yl]methanol
CID 107372980
[1-[6-[4-(5-chloro-2-pyridinyl)piperazin-1-yl]pyrimidin-4-yl]piperidin-3-yl]methanol
CID 133299161
[1-(5-cyclobutylpyrimidin-2-yl)piperidin-3-yl]methanol
CID 116976106
[6-(3-ethylpiperidin-1-yl)-3-pyridinyl]methanol
CID 61256877
[1-(4-methyl-5-nitro-2-pyridinyl)piperidin-3-yl]methanol
CID 79176830

Frequently Asked Questions

What is the IUPAC name of [1-[5-(hydroxymethyl)pyrazin-2-yl]piperidin-3-yl]methanol?
The IUPAC name of [1-[5-(hydroxymethyl)pyrazin-2-yl]piperidin-3-yl]methanol (CID 107372633) is [1-[5-(hydroxymethyl)pyrazin-2-yl]piperidin-3-yl]methanol.
What is the SMILES notation for [1-[5-(hydroxymethyl)pyrazin-2-yl]piperidin-3-yl]methanol?
The canonical SMILES for [1-[5-(hydroxymethyl)pyrazin-2-yl]piperidin-3-yl]methanol is OCc1cnc(N2CCCC(CO)C2)cn1.
What is the InChIKey of [1-[5-(hydroxymethyl)pyrazin-2-yl]piperidin-3-yl]methanol?
The InChIKey is XBYAOIOSIGMDAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O2/c15-7-9-2-1-3-14(6-9)11-5-12-10(8-16)4-13-11/h4-5,9,15-16H,1-3,6-8H2.
What are the key properties of [1-[5-(hydroxymethyl)pyrazin-2-yl]piperidin-3-yl]methanol?
[1-[5-(hydroxymethyl)pyrazin-2-yl]piperidin-3-yl]methanol has a molecular weight of 223.28 g/mol, XLogP of 0.18, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[5-(hydroxymethyl)pyrazin-2-yl]piperidin-3-yl]methanol is sourced from PubChem (CID 107372633), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).