2-(3-methoxyphenyl)-6-[1-(2-phenylethyl)piperidin-4-yl]pyrazine

C24H27N3O — CID 95819598

IUPAC2-(3-methoxyphenyl)-6-[1-(2-phenylethyl)piperidin-4-yl]pyrazine
SMILESCOc1cccc(-c2cncc(C3CCN(CCc4ccccc4)CC3)n2)c1
InChIInChI=1S/C24H27N3O/c1-28-22-9-5-8-21(16-22)24-18-25-17-23(26-24)20-11-14-27(15-12-20)13-10-19-6-3-2-4-7-19/h2-9,16-18,20H,10-15H2,1H3
InChIKeyRYAUWORUFSCLQF-UHFFFAOYSA-N
MW373.50 g/mol
LogP4.57
Rot. Bonds6

About 2-(3-methoxyphenyl)-6-[1-(2-phenylethyl)piperidin-4-yl]pyrazine

2-(3-methoxyphenyl)-6-[1-(2-phenylethyl)piperidin-4-yl]pyrazine (PubChem CID 95819598) has the molecular formula C24H27N3O and a molecular weight of 373.50 g/mol. Its IUPAC name is 2-(3-methoxyphenyl)-6-[1-(2-phenylethyl)piperidin-4-yl]pyrazine.

Molecular Properties

Compound Name2-(3-methoxyphenyl)-6-[1-(2-phenylethyl)piperidin-4-yl]pyrazine
PubChem CID95819598
Molecular FormulaC24H27N3O
Molecular Weight373.50 g/mol
Exact Mass373.22
IUPAC Name2-(3-methoxyphenyl)-6-[1-(2-phenylethyl)piperidin-4-yl]pyrazine
SMILESCOc1cccc(-c2cncc(C3CCN(CCc4ccccc4)CC3)n2)c1
InChIInChI=1S/C24H27N3O/c1-28-22-9-5-8-21(16-22)24-18-25-17-23(26-24)20-11-14-27(15-12-20)13-10-19-6-3-2-4-7-19/h2-9,16-18,20H,10-15H2,1H3
InChIKeyRYAUWORUFSCLQF-UHFFFAOYSA-N
XLogP4.57
TPSA38.25 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.50
LogP ≤ 54.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

3-(3-methoxyphenyl)-5-[(3R)-1-(2-phenylethyl)pyrrolidin-3-yl]-1,2,4-oxadiazole
CID 95829995
1-[2-(3-methoxyphenyl)ethyl]piperidin-4-ol
CID 82083424
2-hydroxy-1-[(3R)-3-[6-(3-methoxyphenyl)pyrazin-2-yl]piperidin-1-yl]ethanone
CID 95819992
1-[3-[6-(3-methoxyphenyl)pyrazin-2-yl]piperidin-1-yl]-2-pyrrolidin-1-ylethanone
CID 110255376
2-[(3R)-3-[6-(3-methoxyphenyl)pyrazin-2-yl]piperidin-1-yl]-1-piperidin-1-ylethanone
CID 95819602
1-[(3R)-3-[6-(3-methoxyphenyl)pyrazin-2-yl]piperidin-1-yl]-2-pyridin-4-ylethanone
CID 95819824
1-[(3S)-3-[6-(3-methoxyphenyl)-2-pyridinyl]piperidin-1-yl]-3-phenylpropan-1-one
CID 95809371
6-[1-[(3-methoxyphenyl)methyl]piperidin-4-yl]-N-pyrazin-2-ylpyrazin-2-amine
CID 110094104
[(3R)-3-[6-(3-methoxyphenyl)pyrazin-2-yl]piperidin-1-yl]-(1-methylpyrazol-4-yl)methanone
CID 95820010
1-[2-(3-methoxyphenyl)ethyl]-4-[2-(4-methoxyphenyl)ethyl]piperidine;hydrochloride
CID 127043453
4-[[2-(2-methoxyethyl)pyrimidin-5-yl]methyl]-2-[6-(3-methoxyphenyl)pyrazin-2-yl]morpholine
CID 127251049
1-[4-[6-(3-fluorophenyl)pyrazin-2-yl]piperidin-1-yl]-4-phenylbutan-1-one
CID 95820069

Frequently Asked Questions

What is the IUPAC name of 2-(3-methoxyphenyl)-6-[1-(2-phenylethyl)piperidin-4-yl]pyrazine?
The IUPAC name of 2-(3-methoxyphenyl)-6-[1-(2-phenylethyl)piperidin-4-yl]pyrazine (CID 95819598) is 2-(3-methoxyphenyl)-6-[1-(2-phenylethyl)piperidin-4-yl]pyrazine.
What is the SMILES notation for 2-(3-methoxyphenyl)-6-[1-(2-phenylethyl)piperidin-4-yl]pyrazine?
The canonical SMILES for 2-(3-methoxyphenyl)-6-[1-(2-phenylethyl)piperidin-4-yl]pyrazine is COc1cccc(-c2cncc(C3CCN(CCc4ccccc4)CC3)n2)c1.
What is the InChIKey of 2-(3-methoxyphenyl)-6-[1-(2-phenylethyl)piperidin-4-yl]pyrazine?
The InChIKey is RYAUWORUFSCLQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H27N3O/c1-28-22-9-5-8-21(16-22)24-18-25-17-23(26-24)20-11-14-27(15-12-20)13-10-19-6-3-2-4-7-19/h2-9,16-18,20H,10-15H2,1H3.
What are the key properties of 2-(3-methoxyphenyl)-6-[1-(2-phenylethyl)piperidin-4-yl]pyrazine?
2-(3-methoxyphenyl)-6-[1-(2-phenylethyl)piperidin-4-yl]pyrazine has a molecular weight of 373.50 g/mol, XLogP of 4.57, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methoxyphenyl)-6-[1-(2-phenylethyl)piperidin-4-yl]pyrazine is sourced from PubChem (CID 95819598), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).