4-(4-fluorophenyl)-1-[6-(4-methoxyphenyl)pyrazin-2-yl]piperidin-4-ol

C22H22FN3O2 — CID 155263820

IUPAC4-(4-fluorophenyl)-1-[6-(4-methoxyphenyl)pyrazin-2-yl]piperidin-4-ol
SMILESCOc1ccc(-c2cncc(N3CCC(O)(c4ccc(F)cc4)CC3)n2)cc1
InChIInChI=1S/C22H22FN3O2/c1-28-19-8-2-16(3-9-19)20-14-24-15-21(25-20)26-12-10-22(27,11-13-26)17-4-6-18(23)7-5-17/h2-9,14-15,27H,10-13H2,1H3
InChIKeyIREUPJUSUFWONO-UHFFFAOYSA-N
MW379.44 g/mol
LogP3.78
Rot. Bonds4

About 4-(4-fluorophenyl)-1-[6-(4-methoxyphenyl)pyrazin-2-yl]piperidin-4-ol

4-(4-fluorophenyl)-1-[6-(4-methoxyphenyl)pyrazin-2-yl]piperidin-4-ol (PubChem CID 155263820) has the molecular formula C22H22FN3O2 and a molecular weight of 379.44 g/mol. Its IUPAC name is 4-(4-fluorophenyl)-1-[6-(4-methoxyphenyl)pyrazin-2-yl]piperidin-4-ol.

Molecular Properties

Compound Name4-(4-fluorophenyl)-1-[6-(4-methoxyphenyl)pyrazin-2-yl]piperidin-4-ol
PubChem CID155263820
Molecular FormulaC22H22FN3O2
Molecular Weight379.44 g/mol
Exact Mass379.17
IUPAC Name4-(4-fluorophenyl)-1-[6-(4-methoxyphenyl)pyrazin-2-yl]piperidin-4-ol
SMILESCOc1ccc(-c2cncc(N3CCC(O)(c4ccc(F)cc4)CC3)n2)cc1
InChIInChI=1S/C22H22FN3O2/c1-28-19-8-2-16(3-9-19)20-14-24-15-21(25-20)26-12-10-22(27,11-13-26)17-4-6-18(23)7-5-17/h2-9,14-15,27H,10-13H2,1H3
InChIKeyIREUPJUSUFWONO-UHFFFAOYSA-N
XLogP3.78
TPSA58.48 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500379.44
LogP ≤ 53.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-(4-fluorophenyl)-1-[6-(4-methylsulfonylphenyl)pyrazin-2-yl]piperidin-4-ol
CID 155263877
4-(4-fluorophenyl)-1-(6-pyrimidin-5-ylpyrazin-2-yl)piperidin-4-ol
CID 155263855
4-(4-fluorophenyl)-1-[6-(4-methylpyrazol-1-yl)pyrazin-2-yl]piperidin-4-ol
CID 155263942
4-(4-fluorophenyl)-1-quinoxalin-2-ylpiperidin-4-ol
CID 155263860
4-[6-[4-(4-methoxyphenyl)piperazin-1-yl]pyrazin-2-yl]benzamide
CID 6482931
4-(4-fluorophenyl)-1-[(2R)-2-hydroxy-2-(4-methoxyphenyl)ethyl]piperidin-4-ol
CID 51501554
1-[6-[(Z)-3-amino-1-methyliminobut-2-en-2-yl]pyrazin-2-yl]-4-(4-fluorophenyl)piperidin-4-ol
CID 155717488
4-(4-fluorophenyl)-1-(4-methoxy-6-methylpyrimidin-2-yl)piperidin-4-ol
CID 3228710
4-(3,5-dimethoxyphenyl)-1-(6-fluoro-2-pyridinyl)piperidin-4-ol
CID 133362438
2-(4-ethoxyphenyl)-6-[4-(4-methylphenyl)piperazin-1-yl]pyrazine
CID 6482907
2-(4-fluorophenyl)-6-[4-(6-methyl-3-pyridinyl)piperidin-1-yl]pyrazine
CID 166208312
2-[4-(4-fluorophenyl)piperazin-1-yl]-6-(furan-3-yl)pyrazine
CID 6482911

Frequently Asked Questions

What is the IUPAC name of 4-(4-fluorophenyl)-1-[6-(4-methoxyphenyl)pyrazin-2-yl]piperidin-4-ol?
The IUPAC name of 4-(4-fluorophenyl)-1-[6-(4-methoxyphenyl)pyrazin-2-yl]piperidin-4-ol (CID 155263820) is 4-(4-fluorophenyl)-1-[6-(4-methoxyphenyl)pyrazin-2-yl]piperidin-4-ol.
What is the SMILES notation for 4-(4-fluorophenyl)-1-[6-(4-methoxyphenyl)pyrazin-2-yl]piperidin-4-ol?
The canonical SMILES for 4-(4-fluorophenyl)-1-[6-(4-methoxyphenyl)pyrazin-2-yl]piperidin-4-ol is COc1ccc(-c2cncc(N3CCC(O)(c4ccc(F)cc4)CC3)n2)cc1.
What is the InChIKey of 4-(4-fluorophenyl)-1-[6-(4-methoxyphenyl)pyrazin-2-yl]piperidin-4-ol?
The InChIKey is IREUPJUSUFWONO-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H22FN3O2/c1-28-19-8-2-16(3-9-19)20-14-24-15-21(25-20)26-12-10-22(27,11-13-26)17-4-6-18(23)7-5-17/h2-9,14-15,27H,10-13H2,1H3.
What are the key properties of 4-(4-fluorophenyl)-1-[6-(4-methoxyphenyl)pyrazin-2-yl]piperidin-4-ol?
4-(4-fluorophenyl)-1-[6-(4-methoxyphenyl)pyrazin-2-yl]piperidin-4-ol has a molecular weight of 379.44 g/mol, XLogP of 3.78, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-fluorophenyl)-1-[6-(4-methoxyphenyl)pyrazin-2-yl]piperidin-4-ol is sourced from PubChem (CID 155263820), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).