2-(4-fluorophenyl)-6-[4-(6-methyl-3-pyridinyl)piperidin-1-yl]pyrazine

C21H21FN4 — CID 166208312

IUPAC2-(4-fluorophenyl)-6-[4-(6-methyl-3-pyridinyl)piperidin-1-yl]pyrazine
SMILESCc1ccc(C2CCN(c3cncc(-c4ccc(F)cc4)n3)CC2)cn1
InChIInChI=1S/C21H21FN4/c1-15-2-3-18(12-24-15)16-8-10-26(11-9-16)21-14-23-13-20(25-21)17-4-6-19(22)7-5-17/h2-7,12-14,16H,8-11H2,1H3
InChIKeyURVMASIVPAEOGA-UHFFFAOYSA-N
MW348.43 g/mol
LogP4.37
Rot. Bonds3

About 2-(4-fluorophenyl)-6-[4-(6-methyl-3-pyridinyl)piperidin-1-yl]pyrazine

2-(4-fluorophenyl)-6-[4-(6-methyl-3-pyridinyl)piperidin-1-yl]pyrazine (PubChem CID 166208312) has the molecular formula C21H21FN4 and a molecular weight of 348.43 g/mol. Its IUPAC name is 2-(4-fluorophenyl)-6-[4-(6-methyl-3-pyridinyl)piperidin-1-yl]pyrazine.

Molecular Properties

Compound Name2-(4-fluorophenyl)-6-[4-(6-methyl-3-pyridinyl)piperidin-1-yl]pyrazine
PubChem CID166208312
Molecular FormulaC21H21FN4
Molecular Weight348.43 g/mol
Exact Mass348.18
IUPAC Name2-(4-fluorophenyl)-6-[4-(6-methyl-3-pyridinyl)piperidin-1-yl]pyrazine
SMILESCc1ccc(C2CCN(c3cncc(-c4ccc(F)cc4)n3)CC2)cn1
InChIInChI=1S/C21H21FN4/c1-15-2-3-18(12-24-15)16-8-10-26(11-9-16)21-14-23-13-20(25-21)17-4-6-19(22)7-5-17/h2-7,12-14,16H,8-11H2,1H3
InChIKeyURVMASIVPAEOGA-UHFFFAOYSA-N
XLogP4.37
TPSA41.91 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.43
LogP ≤ 54.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

4-(4-fluorophenyl)-1-[6-(4-methoxyphenyl)pyrazin-2-yl]piperidin-4-ol
CID 155263820
2-[4-(4-methyl-1,2,4-triazol-3-yl)piperidin-1-yl]-6-phenylpyrazine
CID 166201251
1-[4-(6-methyl-3-pyridinyl)piperidin-1-yl]ethanone
CID 134601157
2-[4-(4-fluorophenyl)piperazin-1-yl]-6-(furan-3-yl)pyrazine
CID 6482911
4-(4-fluorophenyl)-1-[6-(4-methylsulfonylphenyl)pyrazin-2-yl]piperidin-4-ol
CID 155263877
4-(6-methyl-3-pyridinyl)piperidine-1-carboxamide
CID 127813854
2-(4-ethoxyphenyl)-6-[4-(4-methylphenyl)piperazin-1-yl]pyrazine
CID 6482907
5-[4-(4-fluorophenyl)piperidin-1-yl]pyrazine-2-carbonitrile
CID 133485866
2-[4-(3-methoxyphenyl)piperidin-1-yl]-6-methylpyrazine
CID 133469302
4-(4-fluorophenyl)-1-(6-pyrimidin-5-ylpyrazin-2-yl)piperidin-4-ol
CID 155263855
2-phenyl-6-piperazin-1-ylpyrazine;hydrochloride
CID 90674681
4-[6-[4-(2-fluorophenyl)piperazin-1-yl]pyrazin-2-yl]-N,N-dimethylaniline
CID 6482838

Frequently Asked Questions

What is the IUPAC name of 2-(4-fluorophenyl)-6-[4-(6-methyl-3-pyridinyl)piperidin-1-yl]pyrazine?
The IUPAC name of 2-(4-fluorophenyl)-6-[4-(6-methyl-3-pyridinyl)piperidin-1-yl]pyrazine (CID 166208312) is 2-(4-fluorophenyl)-6-[4-(6-methyl-3-pyridinyl)piperidin-1-yl]pyrazine.
What is the SMILES notation for 2-(4-fluorophenyl)-6-[4-(6-methyl-3-pyridinyl)piperidin-1-yl]pyrazine?
The canonical SMILES for 2-(4-fluorophenyl)-6-[4-(6-methyl-3-pyridinyl)piperidin-1-yl]pyrazine is Cc1ccc(C2CCN(c3cncc(-c4ccc(F)cc4)n3)CC2)cn1.
What is the InChIKey of 2-(4-fluorophenyl)-6-[4-(6-methyl-3-pyridinyl)piperidin-1-yl]pyrazine?
The InChIKey is URVMASIVPAEOGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H21FN4/c1-15-2-3-18(12-24-15)16-8-10-26(11-9-16)21-14-23-13-20(25-21)17-4-6-19(22)7-5-17/h2-7,12-14,16H,8-11H2,1H3.
What are the key properties of 2-(4-fluorophenyl)-6-[4-(6-methyl-3-pyridinyl)piperidin-1-yl]pyrazine?
2-(4-fluorophenyl)-6-[4-(6-methyl-3-pyridinyl)piperidin-1-yl]pyrazine has a molecular weight of 348.43 g/mol, XLogP of 4.37, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-fluorophenyl)-6-[4-(6-methyl-3-pyridinyl)piperidin-1-yl]pyrazine is sourced from PubChem (CID 166208312), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).