1-[4-(4-methoxyphenyl)phenyl]piperidine

C18H21NO — CID 54529993

IUPAC1-[4-(4-methoxyphenyl)phenyl]piperidine
SMILESCOc1ccc(-c2ccc(N3CCCCC3)cc2)cc1
InChIInChI=1S/C18H21NO/c1-20-18-11-7-16(8-12-18)15-5-9-17(10-6-15)19-13-3-2-4-14-19/h5-12H,2-4,13-14H2,1H3
InChIKeyYVVLZBJIBCQJRO-UHFFFAOYSA-N
MW267.37 g/mol
LogP4.35
Rot. Bonds3

About 1-[4-(4-methoxyphenyl)phenyl]piperidine

1-[4-(4-methoxyphenyl)phenyl]piperidine (PubChem CID 54529993) has the molecular formula C18H21NO and a molecular weight of 267.37 g/mol. Its IUPAC name is 1-[4-(4-methoxyphenyl)phenyl]piperidine.

Molecular Properties

Compound Name1-[4-(4-methoxyphenyl)phenyl]piperidine
PubChem CID54529993
Molecular FormulaC18H21NO
Molecular Weight267.37 g/mol
Exact Mass267.16
IUPAC Name1-[4-(4-methoxyphenyl)phenyl]piperidine
SMILESCOc1ccc(-c2ccc(N3CCCCC3)cc2)cc1
InChIInChI=1S/C18H21NO/c1-20-18-11-7-16(8-12-18)15-5-9-17(10-6-15)19-13-3-2-4-14-19/h5-12H,2-4,13-14H2,1H3
InChIKeyYVVLZBJIBCQJRO-UHFFFAOYSA-N
XLogP4.35
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.37
LogP ≤ 54.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-[4-(4-methoxyphenyl)phenyl]piperidine?
The IUPAC name of 1-[4-(4-methoxyphenyl)phenyl]piperidine (CID 54529993) is 1-[4-(4-methoxyphenyl)phenyl]piperidine.
What is the SMILES notation for 1-[4-(4-methoxyphenyl)phenyl]piperidine?
The canonical SMILES for 1-[4-(4-methoxyphenyl)phenyl]piperidine is COc1ccc(-c2ccc(N3CCCCC3)cc2)cc1.
What is the InChIKey of 1-[4-(4-methoxyphenyl)phenyl]piperidine?
The InChIKey is YVVLZBJIBCQJRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21NO/c1-20-18-11-7-16(8-12-18)15-5-9-17(10-6-15)19-13-3-2-4-14-19/h5-12H,2-4,13-14H2,1H3.
What are the key properties of 1-[4-(4-methoxyphenyl)phenyl]piperidine?
1-[4-(4-methoxyphenyl)phenyl]piperidine has a molecular weight of 267.37 g/mol, XLogP of 4.35, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-(4-methoxyphenyl)phenyl]piperidine is sourced from PubChem (CID 54529993), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).