N-[1-(oxolan-2-yl)ethyl]-2-(4-phenylphenoxy)acetamide

C20H23NO3 — CID 6468778

IUPACN-[1-(oxolan-2-yl)ethyl]-2-(4-phenylphenoxy)acetamide
SMILESCC(NC(=O)COc1ccc(-c2ccccc2)cc1)C1CCCO1
InChIInChI=1S/C20H23NO3/c1-15(19-8-5-13-23-19)21-20(22)14-24-18-11-9-17(10-12-18)16-6-3-2-4-7-16/h2-4,6-7,9-12,15,19H,5,8,13-14H2,1H3,(H,21,22)
InChIKeyXAVBHEXTKGGCIC-UHFFFAOYSA-N
MW325.41 g/mol
LogP3.42
Rot. Bonds6

About N-[1-(oxolan-2-yl)ethyl]-2-(4-phenylphenoxy)acetamide

N-[1-(oxolan-2-yl)ethyl]-2-(4-phenylphenoxy)acetamide (PubChem CID 6468778) has the molecular formula C20H23NO3 and a molecular weight of 325.41 g/mol. Its IUPAC name is N-[1-(oxolan-2-yl)ethyl]-2-(4-phenylphenoxy)acetamide.

Molecular Properties

Compound NameN-[1-(oxolan-2-yl)ethyl]-2-(4-phenylphenoxy)acetamide
PubChem CID6468778
Molecular FormulaC20H23NO3
Molecular Weight325.41 g/mol
Exact Mass325.17
IUPAC NameN-[1-(oxolan-2-yl)ethyl]-2-(4-phenylphenoxy)acetamide
SMILESCC(NC(=O)COc1ccc(-c2ccccc2)cc1)C1CCCO1
InChIInChI=1S/C20H23NO3/c1-15(19-8-5-13-23-19)21-20(22)14-24-18-11-9-17(10-12-18)16-6-3-2-4-7-16/h2-4,6-7,9-12,15,19H,5,8,13-14H2,1H3,(H,21,22)
InChIKeyXAVBHEXTKGGCIC-UHFFFAOYSA-N
XLogP3.42
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.41
LogP ≤ 53.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-bromophenoxy)-N-[(1R)-1-[(2R)-oxolan-2-yl]ethyl]acetamide
CID 40636423
2-[2-(aminomethyl)phenoxy]-N-[1-(oxolan-2-yl)ethyl]acetamide
CID 43533761
N-[1-(oxolan-2-yl)ethyl]-2-(6,7,8,9-tetrahydrodibenzofuran-2-yloxy)acetamide
CID 43067366
N-[(1S)-1-[(2S)-oxolan-2-yl]ethyl]-4-phenoxybenzamide
CID 35273707
N-[(1R)-1-[(2R)-oxolan-2-yl]ethyl]-3-phenylpropanamide
CID 7346632
2-(2-aminophenyl)-N-[1-(oxolan-2-yl)ethyl]acetamide
CID 43533746
2-(4-bromo-2-chlorophenoxy)-N-[1-(oxolan-2-yl)ethyl]acetamide
CID 2970318
2-(4-chlorophenyl)-N-[(1S)-1-[(2S)-oxolan-2-yl]ethyl]acetamide
CID 42563052
2-(4-aminophenyl)-N-[1-(oxolan-2-yl)ethyl]acetamide
CID 43533745
2-(3-hydroxyphenyl)-N-[1-(oxolan-2-yl)ethyl]acetamide
CID 61399786
2-(1,3-benzothiazol-2-ylmethoxy)-N-[(1R)-1-[(2S)-oxolan-2-yl]ethyl]acetamide
CID 35235298
2-phenoxy-N-propan-2-ylacetamide
CID 3614481

Frequently Asked Questions

What is the IUPAC name of N-[1-(oxolan-2-yl)ethyl]-2-(4-phenylphenoxy)acetamide?
The IUPAC name of N-[1-(oxolan-2-yl)ethyl]-2-(4-phenylphenoxy)acetamide (CID 6468778) is N-[1-(oxolan-2-yl)ethyl]-2-(4-phenylphenoxy)acetamide.
What is the SMILES notation for N-[1-(oxolan-2-yl)ethyl]-2-(4-phenylphenoxy)acetamide?
The canonical SMILES for N-[1-(oxolan-2-yl)ethyl]-2-(4-phenylphenoxy)acetamide is CC(NC(=O)COc1ccc(-c2ccccc2)cc1)C1CCCO1.
What is the InChIKey of N-[1-(oxolan-2-yl)ethyl]-2-(4-phenylphenoxy)acetamide?
The InChIKey is XAVBHEXTKGGCIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23NO3/c1-15(19-8-5-13-23-19)21-20(22)14-24-18-11-9-17(10-12-18)16-6-3-2-4-7-16/h2-4,6-7,9-12,15,19H,5,8,13-14H2,1H3,(H,21,22).
What are the key properties of N-[1-(oxolan-2-yl)ethyl]-2-(4-phenylphenoxy)acetamide?
N-[1-(oxolan-2-yl)ethyl]-2-(4-phenylphenoxy)acetamide has a molecular weight of 325.41 g/mol, XLogP of 3.42, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(oxolan-2-yl)ethyl]-2-(4-phenylphenoxy)acetamide is sourced from PubChem (CID 6468778), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).