N-(oxolan-2-ylmethyl)-2-(4-phenylmethoxyphenoxy)acetamide

C20H23NO4 — CID 18168439

IUPACN-(oxolan-2-ylmethyl)-2-(4-phenylmethoxyphenoxy)acetamide
SMILESO=C(COc1ccc(OCc2ccccc2)cc1)NCC1CCCO1
InChIInChI=1S/C20H23NO4/c22-20(21-13-19-7-4-12-23-19)15-25-18-10-8-17(9-11-18)24-14-16-5-2-1-3-6-16/h1-3,5-6,8-11,19H,4,7,12-15H2,(H,21,22)
InChIKeyBUXISWWUNSUUCE-UHFFFAOYSA-N
MW341.41 g/mol
LogP2.94
Rot. Bonds8

About N-(oxolan-2-ylmethyl)-2-(4-phenylmethoxyphenoxy)acetamide

N-(oxolan-2-ylmethyl)-2-(4-phenylmethoxyphenoxy)acetamide (PubChem CID 18168439) has the molecular formula C20H23NO4 and a molecular weight of 341.41 g/mol. Its IUPAC name is N-(oxolan-2-ylmethyl)-2-(4-phenylmethoxyphenoxy)acetamide.

Molecular Properties

Compound NameN-(oxolan-2-ylmethyl)-2-(4-phenylmethoxyphenoxy)acetamide
PubChem CID18168439
Molecular FormulaC20H23NO4
Molecular Weight341.41 g/mol
Exact Mass341.16
IUPAC NameN-(oxolan-2-ylmethyl)-2-(4-phenylmethoxyphenoxy)acetamide
SMILESO=C(COc1ccc(OCc2ccccc2)cc1)NCC1CCCO1
InChIInChI=1S/C20H23NO4/c22-20(21-13-19-7-4-12-23-19)15-25-18-10-8-17(9-11-18)24-14-16-5-2-1-3-6-16/h1-3,5-6,8-11,19H,4,7,12-15H2,(H,21,22)
InChIKeyBUXISWWUNSUUCE-UHFFFAOYSA-N
XLogP2.94
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 ≤ 52.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-naphthalen-2-yloxy-N-[[(2S)-oxolan-2-yl]methyl]acetamide
CID 874788
N-(oxolan-2-ylmethyl)-4-(phenoxymethyl)benzamide
CID 24684666
1-[[(2R)-oxolan-2-yl]methyl]-3-(4-phenylmethoxyphenyl)thiourea
CID 8022384
N-[[4-(oxolan-2-ylmethoxy)phenyl]methyl]-2-phenoxyacetamide
CID 42961546
N-(oxolan-2-ylmethyl)-2-(2-phenylphenoxy)acetamide
CID 18168438
2-(3,4-dichlorophenoxy)-N-[[(2R)-oxolan-2-yl]methyl]acetamide
CID 2419982
2-[2-[2-oxo-2-(oxolan-2-ylmethylamino)ethoxy]phenyl]acetic acid
CID 80721764
2-cyano-3-[4-[2-oxo-2-(oxolan-2-ylmethylamino)ethoxy]phenyl]-N-(2-phenylethyl)prop-2-enamide
CID 3140809
N-(oxolan-2-ylmethyl)-5-(phenoxymethyl)furan-2-carboxamide
CID 24980461
2-[4-(dimethylsulfamoyl)phenoxy]-N-[[(2R)-oxolan-2-yl]methyl]acetamide
CID 27261642
N-(oxolan-2-ylmethyl)-3-[[2-oxo-2-(4-phenylmethoxyanilino)ethyl]amino]benzamide
CID 54836976
N-(oxolan-2-ylmethyl)-3-[[2-(4-phenylmethoxyanilino)acetyl]amino]benzamide
CID 54821908

Frequently Asked Questions

What is the IUPAC name of N-(oxolan-2-ylmethyl)-2-(4-phenylmethoxyphenoxy)acetamide?
The IUPAC name of N-(oxolan-2-ylmethyl)-2-(4-phenylmethoxyphenoxy)acetamide (CID 18168439) is N-(oxolan-2-ylmethyl)-2-(4-phenylmethoxyphenoxy)acetamide.
What is the SMILES notation for N-(oxolan-2-ylmethyl)-2-(4-phenylmethoxyphenoxy)acetamide?
The canonical SMILES for N-(oxolan-2-ylmethyl)-2-(4-phenylmethoxyphenoxy)acetamide is O=C(COc1ccc(OCc2ccccc2)cc1)NCC1CCCO1.
What is the InChIKey of N-(oxolan-2-ylmethyl)-2-(4-phenylmethoxyphenoxy)acetamide?
The InChIKey is BUXISWWUNSUUCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23NO4/c22-20(21-13-19-7-4-12-23-19)15-25-18-10-8-17(9-11-18)24-14-16-5-2-1-3-6-16/h1-3,5-6,8-11,19H,4,7,12-15H2,(H,21,22).
What are the key properties of N-(oxolan-2-ylmethyl)-2-(4-phenylmethoxyphenoxy)acetamide?
N-(oxolan-2-ylmethyl)-2-(4-phenylmethoxyphenoxy)acetamide has a molecular weight of 341.41 g/mol, XLogP of 2.94, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(oxolan-2-ylmethyl)-2-(4-phenylmethoxyphenoxy)acetamide is sourced from PubChem (CID 18168439), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).