N-(4-ethylphenyl)-2-(oxolan-2-yl)acetamide

C14H19NO2 — CID 110696629

IUPACN-(4-ethylphenyl)-2-(oxolan-2-yl)acetamide
SMILESCCc1ccc(NC(=O)CC2CCCO2)cc1
InChIInChI=1S/C14H19NO2/c1-2-11-5-7-12(8-6-11)15-14(16)10-13-4-3-9-17-13/h5-8,13H,2-4,9-10H2,1H3,(H,15,16)
InChIKeyRYXCLMJYLVDNTK-UHFFFAOYSA-N
MW233.31 g/mol
LogP2.76
Rot. Bonds4

About N-(4-ethylphenyl)-2-(oxolan-2-yl)acetamide

N-(4-ethylphenyl)-2-(oxolan-2-yl)acetamide (PubChem CID 110696629) has the molecular formula C14H19NO2 and a molecular weight of 233.31 g/mol. Its IUPAC name is N-(4-ethylphenyl)-2-(oxolan-2-yl)acetamide.

Molecular Properties

Compound NameN-(4-ethylphenyl)-2-(oxolan-2-yl)acetamide
PubChem CID110696629
Molecular FormulaC14H19NO2
Molecular Weight233.31 g/mol
Exact Mass233.14
IUPAC NameN-(4-ethylphenyl)-2-(oxolan-2-yl)acetamide
SMILESCCc1ccc(NC(=O)CC2CCCO2)cc1
InChIInChI=1S/C14H19NO2/c1-2-11-5-7-12(8-6-11)15-14(16)10-13-4-3-9-17-13/h5-8,13H,2-4,9-10H2,1H3,(H,15,16)
InChIKeyRYXCLMJYLVDNTK-UHFFFAOYSA-N
XLogP2.76
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.31
LogP ≤ 52.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(4-ethylphenyl)-3-(oxolan-2-ylmethylamino)propanamide
CID 109016072
N-[4-(dimethylamino)phenyl]-2-(oxolan-2-yl)acetamide
CID 110696648
N-[4-[(cyclopropylamino)methyl]phenyl]-2-(oxan-2-yl)acetamide
CID 106910580
N-(4-ethylphenyl)-2-[methylsulfonyl(oxolan-2-ylmethyl)amino]acetamide
CID 113149685
(2R)-4-(4-ethylanilino)-4-oxo-2-[[(2S)-oxolan-2-yl]methylamino]butanoic acid
CID 7166006
2-(oxolan-2-yl)-N-(4-piperidin-1-ylphenyl)acetamide
CID 110696650
N-(3,5-dimethylphenyl)-2-(oxolan-2-yl)acetamide
CID 47209277
N-[4-(4-methylpiperidin-1-yl)phenyl]-2-(oxolan-2-yl)acetamide
CID 110696651
N-[4-[[(3R)-2,5-dioxopyrrolidin-3-yl]methyl]phenyl]-2-[(2S)-oxolan-2-yl]acetamide
CID 95774368
2-(oxan-2-yl)-N-[4-(trifluoromethyl)phenyl]acetamide
CID 110423473
2-methyl-2-[4-[[2-(oxan-2-yl)acetyl]amino]phenyl]propanoic acid
CID 120688056
N-[3-(hydroxymethyl)phenyl]-2-(oxolan-2-yl)acetamide
CID 65155963

Frequently Asked Questions

What is the IUPAC name of N-(4-ethylphenyl)-2-(oxolan-2-yl)acetamide?
The IUPAC name of N-(4-ethylphenyl)-2-(oxolan-2-yl)acetamide (CID 110696629) is N-(4-ethylphenyl)-2-(oxolan-2-yl)acetamide.
What is the SMILES notation for N-(4-ethylphenyl)-2-(oxolan-2-yl)acetamide?
The canonical SMILES for N-(4-ethylphenyl)-2-(oxolan-2-yl)acetamide is CCc1ccc(NC(=O)CC2CCCO2)cc1.
What is the InChIKey of N-(4-ethylphenyl)-2-(oxolan-2-yl)acetamide?
The InChIKey is RYXCLMJYLVDNTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19NO2/c1-2-11-5-7-12(8-6-11)15-14(16)10-13-4-3-9-17-13/h5-8,13H,2-4,9-10H2,1H3,(H,15,16).
What are the key properties of N-(4-ethylphenyl)-2-(oxolan-2-yl)acetamide?
N-(4-ethylphenyl)-2-(oxolan-2-yl)acetamide has a molecular weight of 233.31 g/mol, XLogP of 2.76, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-ethylphenyl)-2-(oxolan-2-yl)acetamide is sourced from PubChem (CID 110696629), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).