5-methyl-2-[(Z)-2-(4-phenylphenyl)ethenyl]-4-piperidin-1-ylpyridine

C25H26N2 — CID 14441295

IUPAC5-methyl-2-[(Z)-2-(4-phenylphenyl)ethenyl]-4-piperidin-1-ylpyridine
SMILESCc1cnc(/C=C\c2ccc(-c3ccccc3)cc2)cc1N1CCCCC1
InChIInChI=1S/C25H26N2/c1-20-19-26-24(18-25(20)27-16-6-3-7-17-27)15-12-21-10-13-23(14-11-21)22-8-4-2-5-9-22/h2,4-5,8-15,18-19H,3,6-7,16-17H2,1H3/b15-12-
InChIKeyABBQFUMRTMPUKE-QINSGFPZSA-N
MW354.50 g/mol
LogP6.22
Rot. Bonds4

About 5-methyl-2-[(Z)-2-(4-phenylphenyl)ethenyl]-4-piperidin-1-ylpyridine

5-methyl-2-[(Z)-2-(4-phenylphenyl)ethenyl]-4-piperidin-1-ylpyridine (PubChem CID 14441295) has the molecular formula C25H26N2 and a molecular weight of 354.50 g/mol. Its IUPAC name is 5-methyl-2-[(Z)-2-(4-phenylphenyl)ethenyl]-4-piperidin-1-ylpyridine.

Molecular Properties

Compound Name5-methyl-2-[(Z)-2-(4-phenylphenyl)ethenyl]-4-piperidin-1-ylpyridine
PubChem CID14441295
Molecular FormulaC25H26N2
Molecular Weight354.50 g/mol
Exact Mass354.21
IUPAC Name5-methyl-2-[(Z)-2-(4-phenylphenyl)ethenyl]-4-piperidin-1-ylpyridine
SMILESCc1cnc(/C=C\c2ccc(-c3ccccc3)cc2)cc1N1CCCCC1
InChIInChI=1S/C25H26N2/c1-20-19-26-24(18-25(20)27-16-6-3-7-17-27)15-12-21-10-13-23(14-11-21)22-8-4-2-5-9-22/h2,4-5,8-15,18-19H,3,6-7,16-17H2,1H3/b15-12-
InChIKeyABBQFUMRTMPUKE-QINSGFPZSA-N
XLogP6.22
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500354.50
LogP ≤ 56.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-methyl-2-[(Z)-2-(4-phenylphenyl)ethenyl]-4-piperidin-1-ylpyridine?
The IUPAC name of 5-methyl-2-[(Z)-2-(4-phenylphenyl)ethenyl]-4-piperidin-1-ylpyridine (CID 14441295) is 5-methyl-2-[(Z)-2-(4-phenylphenyl)ethenyl]-4-piperidin-1-ylpyridine.
What is the SMILES notation for 5-methyl-2-[(Z)-2-(4-phenylphenyl)ethenyl]-4-piperidin-1-ylpyridine?
The canonical SMILES for 5-methyl-2-[(Z)-2-(4-phenylphenyl)ethenyl]-4-piperidin-1-ylpyridine is Cc1cnc(/C=C\c2ccc(-c3ccccc3)cc2)cc1N1CCCCC1.
What is the InChIKey of 5-methyl-2-[(Z)-2-(4-phenylphenyl)ethenyl]-4-piperidin-1-ylpyridine?
The InChIKey is ABBQFUMRTMPUKE-QINSGFPZSA-N. The full InChI is InChI=1S/C25H26N2/c1-20-19-26-24(18-25(20)27-16-6-3-7-17-27)15-12-21-10-13-23(14-11-21)22-8-4-2-5-9-22/h2,4-5,8-15,18-19H,3,6-7,16-17H2,1H3/b15-12-.
What are the key properties of 5-methyl-2-[(Z)-2-(4-phenylphenyl)ethenyl]-4-piperidin-1-ylpyridine?
5-methyl-2-[(Z)-2-(4-phenylphenyl)ethenyl]-4-piperidin-1-ylpyridine has a molecular weight of 354.50 g/mol, XLogP of 6.22, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-2-[(Z)-2-(4-phenylphenyl)ethenyl]-4-piperidin-1-ylpyridine is sourced from PubChem (CID 14441295), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).