2-[(3R)-1-[(4-fluorophenyl)methyl]piperidin-3-yl]pyrazine

C16H18FN3 — CID 95823928

IUPAC2-[(3R)-1-[(4-fluorophenyl)methyl]piperidin-3-yl]pyrazine
SMILESFc1ccc(CN2CCC[C@@H](c3cnccn3)C2)cc1
InChIInChI=1S/C16H18FN3/c17-15-5-3-13(4-6-15)11-20-9-1-2-14(12-20)16-10-18-7-8-19-16/h3-8,10,14H,1-2,9,11-12H2/t14-/m1/s1
InChIKeyAHXVBWUIIAMNCK-CQSZACIVSA-N
MW271.34 g/mol
LogP3.00
Rot. Bonds3

About 2-[(3R)-1-[(4-fluorophenyl)methyl]piperidin-3-yl]pyrazine

2-[(3R)-1-[(4-fluorophenyl)methyl]piperidin-3-yl]pyrazine (PubChem CID 95823928) has the molecular formula C16H18FN3 and a molecular weight of 271.34 g/mol. Its IUPAC name is 2-[(3R)-1-[(4-fluorophenyl)methyl]piperidin-3-yl]pyrazine.

Molecular Properties

Compound Name2-[(3R)-1-[(4-fluorophenyl)methyl]piperidin-3-yl]pyrazine
PubChem CID95823928
Molecular FormulaC16H18FN3
Molecular Weight271.34 g/mol
Exact Mass271.15
IUPAC Name2-[(3R)-1-[(4-fluorophenyl)methyl]piperidin-3-yl]pyrazine
SMILESFc1ccc(CN2CCC[C@@H](c3cnccn3)C2)cc1
InChIInChI=1S/C16H18FN3/c17-15-5-3-13(4-6-15)11-20-9-1-2-14(12-20)16-10-18-7-8-19-16/h3-8,10,14H,1-2,9,11-12H2/t14-/m1/s1
InChIKeyAHXVBWUIIAMNCK-CQSZACIVSA-N
XLogP3.00
TPSA29.02 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.34
LogP ≤ 53.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-[1-(pyridin-4-ylmethyl)piperidin-3-yl]pyrazine
CID 110256923
2-[(3S)-1-[(3,4-difluorophenyl)methyl]piperidin-3-yl]pyrazine
CID 95829511
2-(4-fluorophenyl)-3-[(3S)-1-[(4-fluorophenyl)methyl]piperidin-3-yl]pyrazine
CID 95818618
3-[1-[(4-fluorophenyl)methyl]piperidin-3-yl]-2H-pyrazolo[3,4-b]pyrazine
CID 46965629
2-[(3R)-1-[(4-fluorophenyl)methyl]piperidin-3-yl]-3-imidazol-1-ylpyrazine
CID 95810845
1-[(4-fluorophenyl)methyl]-3-(1H-imidazol-2-yl)piperidine
CID 75512434
2-(2-ethylimidazol-1-yl)-6-[(3R)-1-[(4-fluorophenyl)methyl]piperidin-3-yl]pyrazine
CID 95815716
2-[(3S)-1-[(5-methylthiophen-2-yl)methyl]piperidin-3-yl]pyrazine
CID 124965345
2-[(3R)-1-[(4-fluorophenyl)methyl]piperidin-3-yl]-6-imidazol-1-ylpyridine
CID 95838563
4-[1-[(4-fluorophenyl)methyl]piperidin-3-yl]-2-pyridin-2-yl-1H-pyrimidin-6-one
CID 136765779
N-methyl-3-[[(3S)-3-pyrazin-2-ylpiperidin-1-yl]methyl]pyridin-2-amine
CID 95846016
5-(4-fluorophenyl)-4-[(3R)-1-[(4-fluorophenyl)methyl]piperidin-3-yl]pyrimidin-2-amine
CID 95806391

Frequently Asked Questions

What is the IUPAC name of 2-[(3R)-1-[(4-fluorophenyl)methyl]piperidin-3-yl]pyrazine?
The IUPAC name of 2-[(3R)-1-[(4-fluorophenyl)methyl]piperidin-3-yl]pyrazine (CID 95823928) is 2-[(3R)-1-[(4-fluorophenyl)methyl]piperidin-3-yl]pyrazine.
What is the SMILES notation for 2-[(3R)-1-[(4-fluorophenyl)methyl]piperidin-3-yl]pyrazine?
The canonical SMILES for 2-[(3R)-1-[(4-fluorophenyl)methyl]piperidin-3-yl]pyrazine is Fc1ccc(CN2CCC[C@@H](c3cnccn3)C2)cc1.
What is the InChIKey of 2-[(3R)-1-[(4-fluorophenyl)methyl]piperidin-3-yl]pyrazine?
The InChIKey is AHXVBWUIIAMNCK-CQSZACIVSA-N. The full InChI is InChI=1S/C16H18FN3/c17-15-5-3-13(4-6-15)11-20-9-1-2-14(12-20)16-10-18-7-8-19-16/h3-8,10,14H,1-2,9,11-12H2/t14-/m1/s1.
What are the key properties of 2-[(3R)-1-[(4-fluorophenyl)methyl]piperidin-3-yl]pyrazine?
2-[(3R)-1-[(4-fluorophenyl)methyl]piperidin-3-yl]pyrazine has a molecular weight of 271.34 g/mol, XLogP of 3.00, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3R)-1-[(4-fluorophenyl)methyl]piperidin-3-yl]pyrazine is sourced from PubChem (CID 95823928), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).