2-[(4-methoxy-3-phenylphenyl)methyl]piperidine

C19H23NO — CID 117451820

IUPAC2-[(4-methoxy-3-phenylphenyl)methyl]piperidine
SMILESCOc1ccc(CC2CCCCN2)cc1-c1ccccc1
InChIInChI=1S/C19H23NO/c1-21-19-11-10-15(13-17-9-5-6-12-20-17)14-18(19)16-7-3-2-4-8-16/h2-4,7-8,10-11,14,17,20H,5-6,9,12-13H2,1H3
InChIKeyIPJZARIIWARWMD-UHFFFAOYSA-N
MW281.40 g/mol
LogP4.05
Rot. Bonds4

About 2-[(4-methoxy-3-phenylphenyl)methyl]piperidine

2-[(4-methoxy-3-phenylphenyl)methyl]piperidine (PubChem CID 117451820) has the molecular formula C19H23NO and a molecular weight of 281.40 g/mol. Its IUPAC name is 2-[(4-methoxy-3-phenylphenyl)methyl]piperidine.

Molecular Properties

Compound Name2-[(4-methoxy-3-phenylphenyl)methyl]piperidine
PubChem CID117451820
Molecular FormulaC19H23NO
Molecular Weight281.40 g/mol
Exact Mass281.18
IUPAC Name2-[(4-methoxy-3-phenylphenyl)methyl]piperidine
SMILESCOc1ccc(CC2CCCCN2)cc1-c1ccccc1
InChIInChI=1S/C19H23NO/c1-21-19-11-10-15(13-17-9-5-6-12-20-17)14-18(19)16-7-3-2-4-8-16/h2-4,7-8,10-11,14,17,20H,5-6,9,12-13H2,1H3
InChIKeyIPJZARIIWARWMD-UHFFFAOYSA-N
XLogP4.05
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.40
LogP ≤ 54.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[(3-chloro-4-methoxyphenyl)methyl]piperidine
CID 82084437
2-[[3-(fluoromethyl)-4-methoxyphenyl]methyl]piperidine
CID 117347458
2-[(4-cyclopropyloxy-3-methoxyphenyl)methyl]piperidine
CID 117408287
2-[[3-methoxy-4-(1-methylpyrrolidin-3-yl)oxyphenyl]methyl]piperidine
CID 117489930
2-[(2,3,6-trimethoxyphenyl)methyl]piperidine
CID 117417665
2-[(3,4-diethoxyphenyl)methyl]piperidine
CID 62791915
2-[[3-(difluoromethyl)-4-methoxyphenyl]methyl]pyrrolidine
CID 117355063
2-[[4-methoxy-3-(trifluoromethyl)phenyl]methyl]pyrrolidine
CID 117401448
2-[(3-fluoro-4,5-dimethoxyphenyl)methyl]piperidine
CID 117386331
(2S)-2-(naphthalen-2-ylmethyl)piperidine
CID 94603397
2-[[4-methoxy-3-(1-methylazetidin-3-yl)oxyphenyl]methyl]pyrrolidine
CID 117442925
2-[(2,3,5-trimethoxyphenyl)methyl]piperidine
CID 117417667

Frequently Asked Questions

What is the IUPAC name of 2-[(4-methoxy-3-phenylphenyl)methyl]piperidine?
The IUPAC name of 2-[(4-methoxy-3-phenylphenyl)methyl]piperidine (CID 117451820) is 2-[(4-methoxy-3-phenylphenyl)methyl]piperidine.
What is the SMILES notation for 2-[(4-methoxy-3-phenylphenyl)methyl]piperidine?
The canonical SMILES for 2-[(4-methoxy-3-phenylphenyl)methyl]piperidine is COc1ccc(CC2CCCCN2)cc1-c1ccccc1.
What is the InChIKey of 2-[(4-methoxy-3-phenylphenyl)methyl]piperidine?
The InChIKey is IPJZARIIWARWMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23NO/c1-21-19-11-10-15(13-17-9-5-6-12-20-17)14-18(19)16-7-3-2-4-8-16/h2-4,7-8,10-11,14,17,20H,5-6,9,12-13H2,1H3.
What are the key properties of 2-[(4-methoxy-3-phenylphenyl)methyl]piperidine?
2-[(4-methoxy-3-phenylphenyl)methyl]piperidine has a molecular weight of 281.40 g/mol, XLogP of 4.05, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-methoxy-3-phenylphenyl)methyl]piperidine is sourced from PubChem (CID 117451820), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).