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

C23H24FN3O — CID 110254812

IUPAC2-(2-fluorophenyl)-3-[1-[(4-methoxyphenyl)methyl]piperidin-3-yl]pyrazine
SMILESCOc1ccc(CN2CCCC(c3nccnc3-c3ccccc3F)C2)cc1
InChIInChI=1S/C23H24FN3O/c1-28-19-10-8-17(9-11-19)15-27-14-4-5-18(16-27)22-23(26-13-12-25-22)20-6-2-3-7-21(20)24/h2-3,6-13,18H,4-5,14-16H2,1H3
InChIKeyZFEMHVWTPHHAEI-UHFFFAOYSA-N
MW377.46 g/mol
LogP4.67
Rot. Bonds5

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

2-(2-fluorophenyl)-3-[1-[(4-methoxyphenyl)methyl]piperidin-3-yl]pyrazine (PubChem CID 110254812) has the molecular formula C23H24FN3O and a molecular weight of 377.46 g/mol. Its IUPAC name is 2-(2-fluorophenyl)-3-[1-[(4-methoxyphenyl)methyl]piperidin-3-yl]pyrazine.

Molecular Properties

Compound Name2-(2-fluorophenyl)-3-[1-[(4-methoxyphenyl)methyl]piperidin-3-yl]pyrazine
PubChem CID110254812
Molecular FormulaC23H24FN3O
Molecular Weight377.46 g/mol
Exact Mass377.19
IUPAC Name2-(2-fluorophenyl)-3-[1-[(4-methoxyphenyl)methyl]piperidin-3-yl]pyrazine
SMILESCOc1ccc(CN2CCCC(c3nccnc3-c3ccccc3F)C2)cc1
InChIInChI=1S/C23H24FN3O/c1-28-19-10-8-17(9-11-19)15-27-14-4-5-18(16-27)22-23(26-13-12-25-22)20-6-2-3-7-21(20)24/h2-3,6-13,18H,4-5,14-16H2,1H3
InChIKeyZFEMHVWTPHHAEI-UHFFFAOYSA-N
XLogP4.67
TPSA38.25 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500377.46
LogP ≤ 54.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2-[(3R)-1-benzylpiperidin-3-yl]-3-(2-fluorophenyl)pyrazine
CID 95818585
2-[(3R)-1-[2-(4-fluorophenoxy)ethyl]piperidin-3-yl]-3-(2-methoxyphenyl)pyrazine
CID 95819239
2-(4-fluorophenyl)-3-[(3S)-1-[(4-fluorophenyl)methyl]piperidin-3-yl]pyrazine
CID 95818618
2-(4-fluorophenyl)-1-[3-[3-(2-fluorophenyl)pyrazin-2-yl]piperidin-1-yl]ethanone
CID 110255072
2-(2-fluorophenyl)-6-[(3R)-1-(pyridin-4-ylmethyl)piperidin-3-yl]pyridine
CID 95809144
2-(2-fluorophenyl)-6-[(3S)-1-(pyridin-4-ylmethyl)piperidin-3-yl]pyridine
CID 95809145
2-(1-benzylsulfonylpiperidin-3-yl)-3-(2-fluorophenyl)pyrazine
CID 110255013
(3R)-3-[4-(2,6-difluorophenyl)-1H-pyrazol-5-yl]-1-[(4-methoxyphenyl)methyl]piperidine
CID 42210375
4-[(3R)-1-[(4-methoxyphenyl)methyl]piperidin-3-yl]-5-(2-methylphenyl)-2-pyridin-4-ylpyrimidine
CID 26344939
2-(dimethylamino)-1-[(3S)-3-[3-(2-fluorophenyl)pyrazin-2-yl]piperidin-1-yl]ethanone
CID 95819329
3-(4-fluorophenyl)-1-[(3S)-3-[3-(2-fluorophenyl)pyrazin-2-yl]piperidin-1-yl]propan-1-one
CID 95819416
[(3S)-3-[3-(2-fluorophenyl)pyrazin-2-yl]piperidin-1-yl]-pyridin-4-ylmethanone
CID 95818958

Frequently Asked Questions

What is the IUPAC name of 2-(2-fluorophenyl)-3-[1-[(4-methoxyphenyl)methyl]piperidin-3-yl]pyrazine?
The IUPAC name of 2-(2-fluorophenyl)-3-[1-[(4-methoxyphenyl)methyl]piperidin-3-yl]pyrazine (CID 110254812) is 2-(2-fluorophenyl)-3-[1-[(4-methoxyphenyl)methyl]piperidin-3-yl]pyrazine.
What is the SMILES notation for 2-(2-fluorophenyl)-3-[1-[(4-methoxyphenyl)methyl]piperidin-3-yl]pyrazine?
The canonical SMILES for 2-(2-fluorophenyl)-3-[1-[(4-methoxyphenyl)methyl]piperidin-3-yl]pyrazine is COc1ccc(CN2CCCC(c3nccnc3-c3ccccc3F)C2)cc1.
What is the InChIKey of 2-(2-fluorophenyl)-3-[1-[(4-methoxyphenyl)methyl]piperidin-3-yl]pyrazine?
The InChIKey is ZFEMHVWTPHHAEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24FN3O/c1-28-19-10-8-17(9-11-19)15-27-14-4-5-18(16-27)22-23(26-13-12-25-22)20-6-2-3-7-21(20)24/h2-3,6-13,18H,4-5,14-16H2,1H3.
What are the key properties of 2-(2-fluorophenyl)-3-[1-[(4-methoxyphenyl)methyl]piperidin-3-yl]pyrazine?
2-(2-fluorophenyl)-3-[1-[(4-methoxyphenyl)methyl]piperidin-3-yl]pyrazine has a molecular weight of 377.46 g/mol, XLogP of 4.67, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-fluorophenyl)-3-[1-[(4-methoxyphenyl)methyl]piperidin-3-yl]pyrazine is sourced from PubChem (CID 110254812), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).