5-[2-(2-hydroxycyclopentyl)piperidin-1-yl]pyrazine-2-carboxylic acid

C15H21N3O3 — CID 122057879

IUPAC5-[2-(2-hydroxycyclopentyl)piperidin-1-yl]pyrazine-2-carboxylic acid
SMILESO=C(O)c1cnc(N2CCCCC2C2CCCC2O)cn1
InChIInChI=1S/C15H21N3O3/c19-13-6-3-4-10(13)12-5-1-2-7-18(12)14-9-16-11(8-17-14)15(20)21/h8-10,12-13,19H,1-7H2,(H,20,21)
InChIKeyUNHGAWRBYPMTDE-UHFFFAOYSA-N
MW291.35 g/mol
LogP1.69
Rot. Bonds3

About 5-[2-(2-hydroxycyclopentyl)piperidin-1-yl]pyrazine-2-carboxylic acid

5-[2-(2-hydroxycyclopentyl)piperidin-1-yl]pyrazine-2-carboxylic acid (PubChem CID 122057879) has the molecular formula C15H21N3O3 and a molecular weight of 291.35 g/mol. Its IUPAC name is 5-[2-(2-hydroxycyclopentyl)piperidin-1-yl]pyrazine-2-carboxylic acid.

Molecular Properties

Compound Name5-[2-(2-hydroxycyclopentyl)piperidin-1-yl]pyrazine-2-carboxylic acid
PubChem CID122057879
Molecular FormulaC15H21N3O3
Molecular Weight291.35 g/mol
Exact Mass291.16
IUPAC Name5-[2-(2-hydroxycyclopentyl)piperidin-1-yl]pyrazine-2-carboxylic acid
SMILESO=C(O)c1cnc(N2CCCCC2C2CCCC2O)cn1
InChIInChI=1S/C15H21N3O3/c19-13-6-3-4-10(13)12-5-1-2-7-18(12)14-9-16-11(8-17-14)15(20)21/h8-10,12-13,19H,1-7H2,(H,20,21)
InChIKeyUNHGAWRBYPMTDE-UHFFFAOYSA-N
XLogP1.69
TPSA86.55 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.35
LogP ≤ 51.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

5-[3-(2-hydroxycyclohexyl)morpholin-4-yl]pyrazine-2-carboxylic acid
CID 122057315
5-[(2R)-2-[(1S,2S)-2-hydroxycyclohexyl]pyrrolidin-1-yl]pyrazine-2-carbonitrile
CID 129491902
5-(azetidin-1-yl)pyrazine-2-carboxylic acid
CID 117102504
5-[2-(5-methylfuran-2-yl)pyrrolidin-1-yl]pyrazine-2-carboxylic acid
CID 122048062
5-(2-methylpiperidin-1-yl)pyridine-2-carboxylic acid
CID 115490753
cyclohexyl-[2-(2-hydroxycyclopentyl)piperidin-1-yl]methanone
CID 79545603
5-(3-hydroxy-8-azabicyclo[3.2.1]octan-8-yl)pyrazine-2-carboxylic acid
CID 107372450
methyl 5-(2-ethylpiperidin-1-yl)pyrazine-2-carboxylate
CID 104696638
methyl 5-(3,4a,5,6,7,7a-hexahydro-2H-cyclopenta[b][1,4]oxazin-4-yl)pyrazine-2-carboxylate
CID 114059771
5-cyclopentylpyrazine-2-carboxylic acid
CID 135241231
[2-(2-hydroxycyclopentyl)piperidin-1-yl]-pyridin-2-ylmethanone
CID 79545297
5-(2-ethylazepan-1-yl)pyridine-2-carboxylic acid
CID 104690117

Frequently Asked Questions

What is the IUPAC name of 5-[2-(2-hydroxycyclopentyl)piperidin-1-yl]pyrazine-2-carboxylic acid?
The IUPAC name of 5-[2-(2-hydroxycyclopentyl)piperidin-1-yl]pyrazine-2-carboxylic acid (CID 122057879) is 5-[2-(2-hydroxycyclopentyl)piperidin-1-yl]pyrazine-2-carboxylic acid.
What is the SMILES notation for 5-[2-(2-hydroxycyclopentyl)piperidin-1-yl]pyrazine-2-carboxylic acid?
The canonical SMILES for 5-[2-(2-hydroxycyclopentyl)piperidin-1-yl]pyrazine-2-carboxylic acid is O=C(O)c1cnc(N2CCCCC2C2CCCC2O)cn1.
What is the InChIKey of 5-[2-(2-hydroxycyclopentyl)piperidin-1-yl]pyrazine-2-carboxylic acid?
The InChIKey is UNHGAWRBYPMTDE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3O3/c19-13-6-3-4-10(13)12-5-1-2-7-18(12)14-9-16-11(8-17-14)15(20)21/h8-10,12-13,19H,1-7H2,(H,20,21).
What are the key properties of 5-[2-(2-hydroxycyclopentyl)piperidin-1-yl]pyrazine-2-carboxylic acid?
5-[2-(2-hydroxycyclopentyl)piperidin-1-yl]pyrazine-2-carboxylic acid has a molecular weight of 291.35 g/mol, XLogP of 1.69, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[2-(2-hydroxycyclopentyl)piperidin-1-yl]pyrazine-2-carboxylic acid is sourced from PubChem (CID 122057879), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).