4-(3-methoxyphenyl)-3-(4-methylphenyl)piperidine

C19H23NO — CID 79432555

IUPAC4-(3-methoxyphenyl)-3-(4-methylphenyl)piperidine
SMILESCOc1cccc(C2CCNCC2c2ccc(C)cc2)c1
InChIInChI=1S/C19H23NO/c1-14-6-8-15(9-7-14)19-13-20-11-10-18(19)16-4-3-5-17(12-16)21-2/h3-9,12,18-20H,10-11,13H2,1-2H3
InChIKeyDMEZNZQREIVBOD-UHFFFAOYSA-N
MW281.40 g/mol
LogP3.86
Rot. Bonds3

About 4-(3-methoxyphenyl)-3-(4-methylphenyl)piperidine

4-(3-methoxyphenyl)-3-(4-methylphenyl)piperidine (PubChem CID 79432555) has the molecular formula C19H23NO and a molecular weight of 281.40 g/mol. Its IUPAC name is 4-(3-methoxyphenyl)-3-(4-methylphenyl)piperidine.

Molecular Properties

Compound Name4-(3-methoxyphenyl)-3-(4-methylphenyl)piperidine
PubChem CID79432555
Molecular FormulaC19H23NO
Molecular Weight281.40 g/mol
Exact Mass281.18
IUPAC Name4-(3-methoxyphenyl)-3-(4-methylphenyl)piperidine
SMILESCOc1cccc(C2CCNCC2c2ccc(C)cc2)c1
InChIInChI=1S/C19H23NO/c1-14-6-8-15(9-7-14)19-13-20-11-10-18(19)16-4-3-5-17(12-16)21-2/h3-9,12,18-20H,10-11,13H2,1-2H3
InChIKeyDMEZNZQREIVBOD-UHFFFAOYSA-N
XLogP3.86
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.40
LogP ≤ 53.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-(3-methoxyphenyl)-3-(4-methylphenyl)piperidine?
The IUPAC name of 4-(3-methoxyphenyl)-3-(4-methylphenyl)piperidine (CID 79432555) is 4-(3-methoxyphenyl)-3-(4-methylphenyl)piperidine.
What is the SMILES notation for 4-(3-methoxyphenyl)-3-(4-methylphenyl)piperidine?
The canonical SMILES for 4-(3-methoxyphenyl)-3-(4-methylphenyl)piperidine is COc1cccc(C2CCNCC2c2ccc(C)cc2)c1.
What is the InChIKey of 4-(3-methoxyphenyl)-3-(4-methylphenyl)piperidine?
The InChIKey is DMEZNZQREIVBOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23NO/c1-14-6-8-15(9-7-14)19-13-20-11-10-18(19)16-4-3-5-17(12-16)21-2/h3-9,12,18-20H,10-11,13H2,1-2H3.
What are the key properties of 4-(3-methoxyphenyl)-3-(4-methylphenyl)piperidine?
4-(3-methoxyphenyl)-3-(4-methylphenyl)piperidine has a molecular weight of 281.40 g/mol, XLogP of 3.86, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-methoxyphenyl)-3-(4-methylphenyl)piperidine is sourced from PubChem (CID 79432555), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).