N-(2,5-dimethylphenyl)-2-(oxolan-2-yl)acetamide

C14H19NO2 — CID 47209144

IUPACN-(2,5-dimethylphenyl)-2-(oxolan-2-yl)acetamide
SMILESCc1ccc(C)c(NC(=O)CC2CCCO2)c1
InChIInChI=1S/C14H19NO2/c1-10-5-6-11(2)13(8-10)15-14(16)9-12-4-3-7-17-12/h5-6,8,12H,3-4,7,9H2,1-2H3,(H,15,16)
InChIKeyDPEVBKFCYDJSHZ-UHFFFAOYSA-N
MW233.31 g/mol
LogP2.81
Rot. Bonds3

About N-(2,5-dimethylphenyl)-2-(oxolan-2-yl)acetamide

N-(2,5-dimethylphenyl)-2-(oxolan-2-yl)acetamide (PubChem CID 47209144) has the molecular formula C14H19NO2 and a molecular weight of 233.31 g/mol. Its IUPAC name is N-(2,5-dimethylphenyl)-2-(oxolan-2-yl)acetamide.

Molecular Properties

Compound NameN-(2,5-dimethylphenyl)-2-(oxolan-2-yl)acetamide
PubChem CID47209144
Molecular FormulaC14H19NO2
Molecular Weight233.31 g/mol
Exact Mass233.14
IUPAC NameN-(2,5-dimethylphenyl)-2-(oxolan-2-yl)acetamide
SMILESCc1ccc(C)c(NC(=O)CC2CCCO2)c1
InChIInChI=1S/C14H19NO2/c1-10-5-6-11(2)13(8-10)15-14(16)9-12-4-3-7-17-12/h5-6,8,12H,3-4,7,9H2,1-2H3,(H,15,16)
InChIKeyDPEVBKFCYDJSHZ-UHFFFAOYSA-N
XLogP2.81
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.31
LogP ≤ 52.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-(2,5-dimethylphenyl)-2-(oxolan-2-yl)acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(2,5-dimethylphenyl)-3-(oxolan-2-ylmethylamino)propanamide
CID 109016066
N-(2-methyl-5-sulfamoylphenyl)-2-(oxolan-2-yl)acetamide
CID 65159878
N-(3,5-dimethylphenyl)-2-(oxolan-2-yl)acetamide
CID 47209277
N-(4-amino-2-methylphenyl)-2-(oxolan-2-yl)acetamide
CID 65152082
N-(5-bromo-2-methylphenyl)-3-(oxolan-2-yl)propanamide
CID 60794150
[2-(2,5-dimethylanilino)-2-oxoethyl]-[[(2R)-oxolan-2-yl]methyl]-(thiophen-2-ylmethyl)azanium
CID 9055138
N-(4-amino-2,5-dimethylphenyl)-2-(oxan-2-yl)acetamide
CID 103144399
1-(2,5-dimethylphenyl)-3-(oxolan-2-yl)urea
CID 110706691
N-[2-[(Z)-N'-hydroxycarbamimidoyl]-3-methylphenyl]-2-(oxolan-2-yl)acetamide
CID 107800881
N-(2-methoxy-5-methylphenyl)-2-(oxolan-2-ylmethylamino)acetamide;hydrochloride
CID 119674247
2-(oxan-2-yl)-N-(2,4,6-trimethylphenyl)acetamide
CID 110419575
N-(2-bromo-4-methylphenyl)-3-(oxolan-2-yl)propanamide
CID 42956762

Frequently Asked Questions

What is the IUPAC name of N-(2,5-dimethylphenyl)-2-(oxolan-2-yl)acetamide?
The IUPAC name of N-(2,5-dimethylphenyl)-2-(oxolan-2-yl)acetamide (CID 47209144) is N-(2,5-dimethylphenyl)-2-(oxolan-2-yl)acetamide.
What is the SMILES notation for N-(2,5-dimethylphenyl)-2-(oxolan-2-yl)acetamide?
The canonical SMILES for N-(2,5-dimethylphenyl)-2-(oxolan-2-yl)acetamide is Cc1ccc(C)c(NC(=O)CC2CCCO2)c1.
What is the InChIKey of N-(2,5-dimethylphenyl)-2-(oxolan-2-yl)acetamide?
The InChIKey is DPEVBKFCYDJSHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19NO2/c1-10-5-6-11(2)13(8-10)15-14(16)9-12-4-3-7-17-12/h5-6,8,12H,3-4,7,9H2,1-2H3,(H,15,16).
What are the key properties of N-(2,5-dimethylphenyl)-2-(oxolan-2-yl)acetamide?
N-(2,5-dimethylphenyl)-2-(oxolan-2-yl)acetamide has a molecular weight of 233.31 g/mol, XLogP of 2.81, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,5-dimethylphenyl)-2-(oxolan-2-yl)acetamide is sourced from PubChem (CID 47209144), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).