N-[2-(2-phenylethyl)oxan-4-yl]acetamide

C15H21NO2 — CID 102519747

IUPACN-[2-(2-phenylethyl)oxan-4-yl]acetamide
SMILESCC(=O)NC1CCOC(CCc2ccccc2)C1
InChIInChI=1S/C15H21NO2/c1-12(17)16-14-9-10-18-15(11-14)8-7-13-5-3-2-4-6-13/h2-6,14-15H,7-11H2,1H3,(H,16,17)
InChIKeyMAFAWGNYJOIUJA-UHFFFAOYSA-N
MW247.34 g/mol
LogP2.30
Rot. Bonds4

About N-[2-(2-phenylethyl)oxan-4-yl]acetamide

N-[2-(2-phenylethyl)oxan-4-yl]acetamide (PubChem CID 102519747) has the molecular formula C15H21NO2 and a molecular weight of 247.34 g/mol. Its IUPAC name is N-[2-(2-phenylethyl)oxan-4-yl]acetamide.

Molecular Properties

Compound NameN-[2-(2-phenylethyl)oxan-4-yl]acetamide
PubChem CID102519747
Molecular FormulaC15H21NO2
Molecular Weight247.34 g/mol
Exact Mass247.16
IUPAC NameN-[2-(2-phenylethyl)oxan-4-yl]acetamide
SMILESCC(=O)NC1CCOC(CCc2ccccc2)C1
InChIInChI=1S/C15H21NO2/c1-12(17)16-14-9-10-18-15(11-14)8-7-13-5-3-2-4-6-13/h2-6,14-15H,7-11H2,1H3,(H,16,17)
InChIKeyMAFAWGNYJOIUJA-UHFFFAOYSA-N
XLogP2.30
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.34
LogP ≤ 52.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-[(2S,4R,6S)-4-acetamido-6-(2-phenylethyl)oxan-2-yl]benzoic acid
CID 50977390
2-(2-phenylethyl)oxetane
CID 13354102
N-[(2S,6R)-2,6-dibenzyloxan-4-yl]acetamide
CID 50960068
N-(oxan-4-yl)-2-(2-phenylethyl)morpholine-4-carboxamide
CID 126776750
1-[5-methyl-2-(2-phenylethyl)morpholin-4-yl]ethanone
CID 110706995
N-[(2S,4R,6S)-2-(7-methoxy-1,3-benzodioxol-5-yl)-6-(2-phenylethyl)oxan-4-yl]acetamide
CID 50951645
amino (2S)-2-(2-phenylethyl)oxolane-3-carboxylate
CID 91512790
1-[4-[2-(2-phenylethyl)morpholine-4-carbonyl]piperidin-1-yl]ethanone
CID 110740943
N-[(5R,6S,8R,10S)-9,9-dimethyl-5-(2-phenylethyl)-4-oxatricyclo[6.2.1.01,6]undecan-10-yl]acetamide
CID 110153175
1-[(2S)-2-(2-phenylethyl)morpholin-4-yl]propan-1-one
CID 95968357
(2S)-2-amino-N-[2-(oxolan-2-yl)ethyl]-4-phenylbutanamide
CID 104984102
5-methyl-2-(2-phenylethyl)-N-propan-2-ylmorpholine-4-carboxamide
CID 110746747

Frequently Asked Questions

What is the IUPAC name of N-[2-(2-phenylethyl)oxan-4-yl]acetamide?
The IUPAC name of N-[2-(2-phenylethyl)oxan-4-yl]acetamide (CID 102519747) is N-[2-(2-phenylethyl)oxan-4-yl]acetamide.
What is the SMILES notation for N-[2-(2-phenylethyl)oxan-4-yl]acetamide?
The canonical SMILES for N-[2-(2-phenylethyl)oxan-4-yl]acetamide is CC(=O)NC1CCOC(CCc2ccccc2)C1.
What is the InChIKey of N-[2-(2-phenylethyl)oxan-4-yl]acetamide?
The InChIKey is MAFAWGNYJOIUJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21NO2/c1-12(17)16-14-9-10-18-15(11-14)8-7-13-5-3-2-4-6-13/h2-6,14-15H,7-11H2,1H3,(H,16,17).
What are the key properties of N-[2-(2-phenylethyl)oxan-4-yl]acetamide?
N-[2-(2-phenylethyl)oxan-4-yl]acetamide has a molecular weight of 247.34 g/mol, XLogP of 2.30, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-phenylethyl)oxan-4-yl]acetamide is sourced from PubChem (CID 102519747), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).