4-benzyl-2-[(4-methoxyphenyl)methyl]morpholine

C19H23NO2 — CID 142864926

IUPAC4-benzyl-2-[(4-methoxyphenyl)methyl]morpholine
SMILESCOc1ccc(CC2CN(Cc3ccccc3)CCO2)cc1
InChIInChI=1S/C19H23NO2/c1-21-18-9-7-16(8-10-18)13-19-15-20(11-12-22-19)14-17-5-3-2-4-6-17/h2-10,19H,11-15H2,1H3
InChIKeySJJZALMCZXWJFN-UHFFFAOYSA-N
MW297.40 g/mol
LogP3.14
Rot. Bonds5

About 4-benzyl-2-[(4-methoxyphenyl)methyl]morpholine

4-benzyl-2-[(4-methoxyphenyl)methyl]morpholine (PubChem CID 142864926) has the molecular formula C19H23NO2 and a molecular weight of 297.40 g/mol. Its IUPAC name is 4-benzyl-2-[(4-methoxyphenyl)methyl]morpholine.

Molecular Properties

Compound Name4-benzyl-2-[(4-methoxyphenyl)methyl]morpholine
PubChem CID142864926
Molecular FormulaC19H23NO2
Molecular Weight297.40 g/mol
Exact Mass297.17
IUPAC Name4-benzyl-2-[(4-methoxyphenyl)methyl]morpholine
SMILESCOc1ccc(CC2CN(Cc3ccccc3)CCO2)cc1
InChIInChI=1S/C19H23NO2/c1-21-18-9-7-16(8-10-18)13-19-15-20(11-12-22-19)14-17-5-3-2-4-6-17/h2-10,19H,11-15H2,1H3
InChIKeySJJZALMCZXWJFN-UHFFFAOYSA-N
XLogP3.14
TPSA21.70 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.40
LogP ≤ 53.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

(2S)-2-benzyl-4-[(2,4-dimethoxyphenyl)methyl]morpholine
CID 29024699
N-[[(2S)-4-benzylmorpholin-2-yl]methyl]-2-(4-methoxyphenyl)acetamide
CID 39472023
(2S)-4-[(5-ethylfuran-2-yl)methyl]-2-[(4-methoxyphenyl)methyl]morpholine
CID 31016043
2-[(4-methoxyphenyl)methyl]-4-[(2-propylpyrimidin-5-yl)methyl]morpholine
CID 45237362
2-(1-benzylpiperidin-4-yl)-4-[(4-methoxyphenyl)methyl]morpholine
CID 129053759
(2S)-4-[(4-methoxyphenyl)methyl]-2-(4-phenylmethoxyphenyl)morpholine
CID 67352433
2-(chloromethyl)-4-[(3-methoxyphenyl)methyl]morpholine
CID 81213549
(2S)-2-[(4-methoxyphenyl)methyl]-4-(4,4,4-trifluorobutyl)morpholine
CID 95126490
2-benzyl-4-(4-methoxyphenyl)sulfonylmorpholine
CID 110643940
(2S)-4-[(4-methoxyphenyl)methyl]morpholine-2-carboxylic acid
CID 51441015
(2R)-4-[(4-methoxyphenyl)methyl]morpholine-2-carboxylic acid
CID 51441017
2-[(3-methoxyphenyl)methyl]-4-[(3,5,6-trimethylpyrazin-2-yl)methyl]morpholine
CID 45237658

Frequently Asked Questions

What is the IUPAC name of 4-benzyl-2-[(4-methoxyphenyl)methyl]morpholine?
The IUPAC name of 4-benzyl-2-[(4-methoxyphenyl)methyl]morpholine (CID 142864926) is 4-benzyl-2-[(4-methoxyphenyl)methyl]morpholine.
What is the SMILES notation for 4-benzyl-2-[(4-methoxyphenyl)methyl]morpholine?
The canonical SMILES for 4-benzyl-2-[(4-methoxyphenyl)methyl]morpholine is COc1ccc(CC2CN(Cc3ccccc3)CCO2)cc1.
What is the InChIKey of 4-benzyl-2-[(4-methoxyphenyl)methyl]morpholine?
The InChIKey is SJJZALMCZXWJFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23NO2/c1-21-18-9-7-16(8-10-18)13-19-15-20(11-12-22-19)14-17-5-3-2-4-6-17/h2-10,19H,11-15H2,1H3.
What are the key properties of 4-benzyl-2-[(4-methoxyphenyl)methyl]morpholine?
4-benzyl-2-[(4-methoxyphenyl)methyl]morpholine has a molecular weight of 297.40 g/mol, XLogP of 3.14, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-benzyl-2-[(4-methoxyphenyl)methyl]morpholine is sourced from PubChem (CID 142864926), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).