5-[(3R)-1-pyrazin-2-ylpiperidin-3-yl]-1,3-oxazole

C12H14N4O — CID 125011496

IUPAC5-[(3R)-1-pyrazin-2-ylpiperidin-3-yl]-1,3-oxazole
SMILESc1cnc(N2CCC[C@@H](c3cnco3)C2)cn1
InChIInChI=1S/C12H14N4O/c1-2-10(11-6-14-9-17-11)8-16(5-1)12-7-13-3-4-15-12/h3-4,6-7,9-10H,1-2,5,8H2/t10-/m1/s1
InChIKeyVQKRAZMNFRGTPL-SNVBAGLBSA-N
MW230.27 g/mol
LogP1.85
Rot. Bonds2

About 5-[(3R)-1-pyrazin-2-ylpiperidin-3-yl]-1,3-oxazole

5-[(3R)-1-pyrazin-2-ylpiperidin-3-yl]-1,3-oxazole (PubChem CID 125011496) has the molecular formula C12H14N4O and a molecular weight of 230.27 g/mol. Its IUPAC name is 5-[(3R)-1-pyrazin-2-ylpiperidin-3-yl]-1,3-oxazole.

Molecular Properties

Compound Name5-[(3R)-1-pyrazin-2-ylpiperidin-3-yl]-1,3-oxazole
PubChem CID125011496
Molecular FormulaC12H14N4O
Molecular Weight230.27 g/mol
Exact Mass230.12
IUPAC Name5-[(3R)-1-pyrazin-2-ylpiperidin-3-yl]-1,3-oxazole
SMILESc1cnc(N2CCC[C@@H](c3cnco3)C2)cn1
InChIInChI=1S/C12H14N4O/c1-2-10(11-6-14-9-17-11)8-16(5-1)12-7-13-3-4-15-12/h3-4,6-7,9-10H,1-2,5,8H2/t10-/m1/s1
InChIKeyVQKRAZMNFRGTPL-SNVBAGLBSA-N
XLogP1.85
TPSA55.05 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.27
LogP ≤ 51.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

2-[(3S)-3-pyridin-2-ylpiperidin-1-yl]pyrazine
CID 95817344
2-[3-(1H-imidazol-2-yl)piperidin-1-yl]pyrazine
CID 133448364
(3S)-1-pyrazin-2-ylpiperidin-3-amine
CID 86277059
N-methyl-6-[(3R)-1-pyrazin-2-ylpiperidin-3-yl]pyrazin-2-amine
CID 95840808
(3S)-N-methyl-1-pyrazin-2-ylpiperidin-3-amine
CID 94476433
3-(1-pyrazin-2-ylpiperidin-3-yl)-6,7-dihydro-5H-pyrrolo[2,1-c][1,2,4]triazole
CID 133292022
N-methyl-6-(1-pyrazin-2-ylpiperidin-3-yl)pyridin-2-amine
CID 110269026
2-(3-ethylpiperidin-1-yl)pyrazine
CID 146424567
2-[3-(bromomethyl)piperidin-1-yl]pyrazine
CID 80674587
2-[(3R)-3-(pyrazin-2-ylmethyl)piperidin-1-yl]pyrazine
CID 95840910
2-[(3S)-3-(pyrazin-2-ylmethyl)piperidin-1-yl]pyrazine
CID 95840909
N-[6-(1-pyrazin-2-ylpiperidin-3-yl)-2-pyridinyl]pyrimidin-2-amine
CID 110269836

Frequently Asked Questions

What is the IUPAC name of 5-[(3R)-1-pyrazin-2-ylpiperidin-3-yl]-1,3-oxazole?
The IUPAC name of 5-[(3R)-1-pyrazin-2-ylpiperidin-3-yl]-1,3-oxazole (CID 125011496) is 5-[(3R)-1-pyrazin-2-ylpiperidin-3-yl]-1,3-oxazole.
What is the SMILES notation for 5-[(3R)-1-pyrazin-2-ylpiperidin-3-yl]-1,3-oxazole?
The canonical SMILES for 5-[(3R)-1-pyrazin-2-ylpiperidin-3-yl]-1,3-oxazole is c1cnc(N2CCC[C@@H](c3cnco3)C2)cn1.
What is the InChIKey of 5-[(3R)-1-pyrazin-2-ylpiperidin-3-yl]-1,3-oxazole?
The InChIKey is VQKRAZMNFRGTPL-SNVBAGLBSA-N. The full InChI is InChI=1S/C12H14N4O/c1-2-10(11-6-14-9-17-11)8-16(5-1)12-7-13-3-4-15-12/h3-4,6-7,9-10H,1-2,5,8H2/t10-/m1/s1.
What are the key properties of 5-[(3R)-1-pyrazin-2-ylpiperidin-3-yl]-1,3-oxazole?
5-[(3R)-1-pyrazin-2-ylpiperidin-3-yl]-1,3-oxazole has a molecular weight of 230.27 g/mol, XLogP of 1.85, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(3R)-1-pyrazin-2-ylpiperidin-3-yl]-1,3-oxazole is sourced from PubChem (CID 125011496), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).