4-(2,3-dihydro-1-benzofuran-5-ylmethyl)-2-phenylmorpholine

C19H21NO2 — CID 131900950

IUPAC4-(2,3-dihydro-1-benzofuran-5-ylmethyl)-2-phenylmorpholine
SMILESc1ccc(C2CN(Cc3ccc4c(c3)CCO4)CCO2)cc1
InChIInChI=1S/C19H21NO2/c1-2-4-16(5-3-1)19-14-20(9-11-22-19)13-15-6-7-18-17(12-15)8-10-21-18/h1-7,12,19H,8-11,13-14H2
InChIKeyFXDVHVZJRQODNC-UHFFFAOYSA-N
MW295.38 g/mol
LogP3.19
Rot. Bonds3

About 4-(2,3-dihydro-1-benzofuran-5-ylmethyl)-2-phenylmorpholine

4-(2,3-dihydro-1-benzofuran-5-ylmethyl)-2-phenylmorpholine (PubChem CID 131900950) has the molecular formula C19H21NO2 and a molecular weight of 295.38 g/mol. Its IUPAC name is 4-(2,3-dihydro-1-benzofuran-5-ylmethyl)-2-phenylmorpholine.

Molecular Properties

Compound Name4-(2,3-dihydro-1-benzofuran-5-ylmethyl)-2-phenylmorpholine
PubChem CID131900950
Molecular FormulaC19H21NO2
Molecular Weight295.38 g/mol
Exact Mass295.16
IUPAC Name4-(2,3-dihydro-1-benzofuran-5-ylmethyl)-2-phenylmorpholine
SMILESc1ccc(C2CN(Cc3ccc4c(c3)CCO4)CCO2)cc1
InChIInChI=1S/C19H21NO2/c1-2-4-16(5-3-1)19-14-20(9-11-22-19)13-15-6-7-18-17(12-15)8-10-21-18/h1-7,12,19H,8-11,13-14H2
InChIKeyFXDVHVZJRQODNC-UHFFFAOYSA-N
XLogP3.19
TPSA21.70 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.38
LogP ≤ 53.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

[4-[(2-phenylmorpholin-4-yl)methyl]phenyl]methanol
CID 110008119
(2S)-4-(2,3-dihydro-1-benzofuran-5-ylmethyl)-2-[(4-fluorophenyl)methyl]morpholine
CID 29001171
1-[2-(2,3-dihydro-1-benzofuran-5-yl)ethyl]-3-phenylpyrrolidine
CID 173048470
1-(2,3-dihydro-1-benzofuran-5-ylmethyl)azetidin-3-amine
CID 65244917
1-[(3S)-1-(2,3-dihydro-1-benzofuran-5-ylmethyl)piperidin-3-yl]-4-phenylpiperazine
CID 92641150
1-(2,3-dihydro-1-benzofuran-5-ylmethyl)-4-methylpyrrolidine-3-carboxylic acid
CID 65062998
4-[(1-ethylpyrazol-4-yl)methyl]-2-phenylmorpholine
CID 75438520
2-[[4-(2,3-dihydro-1-benzofuran-5-ylmethyl)piperazin-1-yl]methyl]-5-phenyl-1,3,4-oxadiazole
CID 9126871
(3aR,6S,7aR)-2-(2,3-dihydro-1-benzofuran-5-ylmethyl)-6-phenyl-3,4,5,6,7,7a-hexahydro-1H-isoindole-3a-carboxylic acid
CID 118764215
(2S)-4-[[4-[(2R)-1-methylsulfonylpropan-2-yl]phenyl]methyl]-2-phenylmorpholine
CID 160875718
1-benzyl-3-[[4-(2,3-dihydro-1-benzofuran-5-ylmethyl)piperazin-1-yl]methyl]imidazolidine-2,4,5-trione
CID 30738722
N-[[1-(2,3-dihydro-1-benzofuran-5-ylmethyl)piperidin-3-yl]methyl]propan-2-amine
CID 63240821

Frequently Asked Questions

What is the IUPAC name of 4-(2,3-dihydro-1-benzofuran-5-ylmethyl)-2-phenylmorpholine?
The IUPAC name of 4-(2,3-dihydro-1-benzofuran-5-ylmethyl)-2-phenylmorpholine (CID 131900950) is 4-(2,3-dihydro-1-benzofuran-5-ylmethyl)-2-phenylmorpholine.
What is the SMILES notation for 4-(2,3-dihydro-1-benzofuran-5-ylmethyl)-2-phenylmorpholine?
The canonical SMILES for 4-(2,3-dihydro-1-benzofuran-5-ylmethyl)-2-phenylmorpholine is c1ccc(C2CN(Cc3ccc4c(c3)CCO4)CCO2)cc1.
What is the InChIKey of 4-(2,3-dihydro-1-benzofuran-5-ylmethyl)-2-phenylmorpholine?
The InChIKey is FXDVHVZJRQODNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21NO2/c1-2-4-16(5-3-1)19-14-20(9-11-22-19)13-15-6-7-18-17(12-15)8-10-21-18/h1-7,12,19H,8-11,13-14H2.
What are the key properties of 4-(2,3-dihydro-1-benzofuran-5-ylmethyl)-2-phenylmorpholine?
4-(2,3-dihydro-1-benzofuran-5-ylmethyl)-2-phenylmorpholine has a molecular weight of 295.38 g/mol, XLogP of 3.19, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,3-dihydro-1-benzofuran-5-ylmethyl)-2-phenylmorpholine is sourced from PubChem (CID 131900950), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).