2-(oxolan-3-yloxy)-N-[(4-phenylmethoxyphenyl)methyl]acetamide

C20H23NO4 — CID 139007932

IUPAC2-(oxolan-3-yloxy)-N-[(4-phenylmethoxyphenyl)methyl]acetamide
SMILESO=C(COC1CCOC1)NCc1ccc(OCc2ccccc2)cc1
InChIInChI=1S/C20H23NO4/c22-20(15-25-19-10-11-23-14-19)21-12-16-6-8-18(9-7-16)24-13-17-4-2-1-3-5-17/h1-9,19H,10-15H2,(H,21,22)
InChIKeyPKAGJCWOHFNMLV-UHFFFAOYSA-N
MW341.41 g/mol
LogP2.69
Rot. Bonds8

About 2-(oxolan-3-yloxy)-N-[(4-phenylmethoxyphenyl)methyl]acetamide

2-(oxolan-3-yloxy)-N-[(4-phenylmethoxyphenyl)methyl]acetamide (PubChem CID 139007932) has the molecular formula C20H23NO4 and a molecular weight of 341.41 g/mol. Its IUPAC name is 2-(oxolan-3-yloxy)-N-[(4-phenylmethoxyphenyl)methyl]acetamide.

Molecular Properties

Compound Name2-(oxolan-3-yloxy)-N-[(4-phenylmethoxyphenyl)methyl]acetamide
PubChem CID139007932
Molecular FormulaC20H23NO4
Molecular Weight341.41 g/mol
Exact Mass341.16
IUPAC Name2-(oxolan-3-yloxy)-N-[(4-phenylmethoxyphenyl)methyl]acetamide
SMILESO=C(COC1CCOC1)NCc1ccc(OCc2ccccc2)cc1
InChIInChI=1S/C20H23NO4/c22-20(15-25-19-10-11-23-14-19)21-12-16-6-8-18(9-7-16)24-13-17-4-2-1-3-5-17/h1-9,19H,10-15H2,(H,21,22)
InChIKeyPKAGJCWOHFNMLV-UHFFFAOYSA-N
XLogP2.69
TPSA56.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.41
LogP ≤ 52.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(4-fluorophenyl)methyl]-2-(4-phenylmethoxyphenoxy)acetamide
CID 7478807
2-amino-2-(oxan-4-yl)-N-[(4-phenylmethoxyphenyl)methyl]acetamide
CID 120786406
2-cyclohexyloxy-N-[[4-(pyridin-3-ylmethoxy)phenyl]methyl]acetamide
CID 55840932
3-[3-(4-phenylmethoxyphenyl)propoxy]oxane
CID 57004951
N-[[3-(morpholin-4-ylmethyl)phenyl]methyl]-2-(4-phenylmethoxyphenoxy)acetamide
CID 55970132
(3S)-N-[[4-[(3-fluorophenyl)methoxy]phenyl]methyl]oxolane-3-carboxamide
CID 95146364
2-[(1S)-3,4-dihydro-1H-isochromen-1-yl]-N-[(4-phenylmethoxyphenyl)methyl]acetamide
CID 97082428
N-(oxolan-2-ylmethyl)-2-(4-phenylmethoxyphenoxy)acetamide
CID 18168439
(4S)-N-benzyl-4-hydroxy-6-(4-phenylmethoxyphenyl)hexanamide
CID 57123573
N-[[4-(oxolan-2-ylmethoxy)phenyl]methyl]-2-phenoxyacetamide
CID 42961546
N-[4-(aminomethyl)phenyl]-2-(oxolan-3-yloxy)acetamide
CID 63557224
[2-oxo-2-[(4-sulfamoylphenyl)methylamino]ethyl] 2-(4-phenylmethoxyphenoxy)acetate
CID 42981356

Frequently Asked Questions

What is the IUPAC name of 2-(oxolan-3-yloxy)-N-[(4-phenylmethoxyphenyl)methyl]acetamide?
The IUPAC name of 2-(oxolan-3-yloxy)-N-[(4-phenylmethoxyphenyl)methyl]acetamide (CID 139007932) is 2-(oxolan-3-yloxy)-N-[(4-phenylmethoxyphenyl)methyl]acetamide.
What is the SMILES notation for 2-(oxolan-3-yloxy)-N-[(4-phenylmethoxyphenyl)methyl]acetamide?
The canonical SMILES for 2-(oxolan-3-yloxy)-N-[(4-phenylmethoxyphenyl)methyl]acetamide is O=C(COC1CCOC1)NCc1ccc(OCc2ccccc2)cc1.
What is the InChIKey of 2-(oxolan-3-yloxy)-N-[(4-phenylmethoxyphenyl)methyl]acetamide?
The InChIKey is PKAGJCWOHFNMLV-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23NO4/c22-20(15-25-19-10-11-23-14-19)21-12-16-6-8-18(9-7-16)24-13-17-4-2-1-3-5-17/h1-9,19H,10-15H2,(H,21,22).
What are the key properties of 2-(oxolan-3-yloxy)-N-[(4-phenylmethoxyphenyl)methyl]acetamide?
2-(oxolan-3-yloxy)-N-[(4-phenylmethoxyphenyl)methyl]acetamide has a molecular weight of 341.41 g/mol, XLogP of 2.69, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(oxolan-3-yloxy)-N-[(4-phenylmethoxyphenyl)methyl]acetamide is sourced from PubChem (CID 139007932), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).