4-(2-methylphenyl)-1-phenylmethoxypiperidine

C19H23NO — CID 57061277

IUPAC4-(2-methylphenyl)-1-phenylmethoxypiperidine
SMILESCc1ccccc1C1CCN(OCc2ccccc2)CC1
InChIInChI=1S/C19H23NO/c1-16-7-5-6-10-19(16)18-11-13-20(14-12-18)21-15-17-8-3-2-4-9-17/h2-10,18H,11-15H2,1H3
InChIKeyIKSIPHPAHGOBAC-UHFFFAOYSA-N
MW281.40 g/mol
LogP4.31
Rot. Bonds4

About 4-(2-methylphenyl)-1-phenylmethoxypiperidine

4-(2-methylphenyl)-1-phenylmethoxypiperidine (PubChem CID 57061277) has the molecular formula C19H23NO and a molecular weight of 281.40 g/mol. Its IUPAC name is 4-(2-methylphenyl)-1-phenylmethoxypiperidine.

Molecular Properties

Compound Name4-(2-methylphenyl)-1-phenylmethoxypiperidine
PubChem CID57061277
Molecular FormulaC19H23NO
Molecular Weight281.40 g/mol
Exact Mass281.18
IUPAC Name4-(2-methylphenyl)-1-phenylmethoxypiperidine
SMILESCc1ccccc1C1CCN(OCc2ccccc2)CC1
InChIInChI=1S/C19H23NO/c1-16-7-5-6-10-19(16)18-11-13-20(14-12-18)21-15-17-8-3-2-4-9-17/h2-10,18H,11-15H2,1H3
InChIKeyIKSIPHPAHGOBAC-UHFFFAOYSA-N
XLogP4.31
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.40
LogP ≤ 54.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

4-tert-butyl-1-phenylmethoxypiperidine
CID 12722207
N,3-dimethyl-1-phenylmethoxypiperidin-4-amine
CID 130653478
N,N-dimethyl-1-[5-(1-phenylmethoxypiperidin-4-yl)thiophen-3-yl]methanamine
CID 174408869
1-[4-(bromomethyl)cyclohexyl]-2-methylbenzene
CID 126696164
cyclopropyl-(4-phenylmethoxypiperazin-1-yl)methanone
CID 118075267
1-phenylmethoxyazetidin-3-amine
CID 162036959
1-benzyl-4-(2,5-dimethylphenyl)piperidine
CID 130137270
1-[(1S,5S)-3-bicyclo[3.2.1]octanyl]-4-(2-methylphenyl)piperidine
CID 124635425
4-[3-[4-(2-methylphenyl)piperidin-1-yl]-3-oxopropyl]benzoic acid
CID 119184332
ethyl 2-oxo-6-(1-phenylmethoxypiperidin-4-yl)hexanoate
CID 22168407
1-[4-(ethenoxymethyl)cyclohexyl]-2-methylbenzene
CID 174875456
1-methyl-2-(4-prop-2-enylcyclohexyl)benzene
CID 173416381

Frequently Asked Questions

What is the IUPAC name of 4-(2-methylphenyl)-1-phenylmethoxypiperidine?
The IUPAC name of 4-(2-methylphenyl)-1-phenylmethoxypiperidine (CID 57061277) is 4-(2-methylphenyl)-1-phenylmethoxypiperidine.
What is the SMILES notation for 4-(2-methylphenyl)-1-phenylmethoxypiperidine?
The canonical SMILES for 4-(2-methylphenyl)-1-phenylmethoxypiperidine is Cc1ccccc1C1CCN(OCc2ccccc2)CC1.
What is the InChIKey of 4-(2-methylphenyl)-1-phenylmethoxypiperidine?
The InChIKey is IKSIPHPAHGOBAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23NO/c1-16-7-5-6-10-19(16)18-11-13-20(14-12-18)21-15-17-8-3-2-4-9-17/h2-10,18H,11-15H2,1H3.
What are the key properties of 4-(2-methylphenyl)-1-phenylmethoxypiperidine?
4-(2-methylphenyl)-1-phenylmethoxypiperidine has a molecular weight of 281.40 g/mol, XLogP of 4.31, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-methylphenyl)-1-phenylmethoxypiperidine is sourced from PubChem (CID 57061277), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).