3-ethoxy-N,4-dimethylbenzamide

C11H15NO2 — CID 59678322

IUPAC3-ethoxy-N,4-dimethylbenzamide
SMILESCCOc1cc(C(=O)NC)ccc1C
InChIInChI=1S/C11H15NO2/c1-4-14-10-7-9(11(13)12-3)6-5-8(10)2/h5-7H,4H2,1-3H3,(H,12,13)
InChIKeyKKFDCEKDRVECGB-UHFFFAOYSA-N
MW193.25 g/mol
LogP1.75
Rot. Bonds3

About 3-ethoxy-N,4-dimethylbenzamide

3-ethoxy-N,4-dimethylbenzamide (PubChem CID 59678322) has the molecular formula C11H15NO2 and a molecular weight of 193.25 g/mol. Its IUPAC name is 3-ethoxy-N,4-dimethylbenzamide.

Molecular Properties

Compound Name3-ethoxy-N,4-dimethylbenzamide
PubChem CID59678322
Molecular FormulaC11H15NO2
Molecular Weight193.25 g/mol
Exact Mass193.11
IUPAC Name3-ethoxy-N,4-dimethylbenzamide
SMILESCCOc1cc(C(=O)NC)ccc1C
InChIInChI=1S/C11H15NO2/c1-4-14-10-7-9(11(13)12-3)6-5-8(10)2/h5-7H,4H2,1-3H3,(H,12,13)
InChIKeyKKFDCEKDRVECGB-UHFFFAOYSA-N
XLogP1.75
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.25
LogP ≤ 51.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-amino-3-ethoxy-N-methylbenzamide
CID 63357452
3-(butylamino)-N,4-dimethylbenzamide
CID 43726955
N-(2-acetamidoethyl)-4-ethoxy-3-methylbenzamide
CID 110762173
4-(butylamino)-3-methoxy-N-methylbenzamide
CID 178010173
ethyl 4-(methylcarbamoyl)benzoate
CID 125143185
N-[(2-ethoxyphenyl)methyl]-3-methoxy-4-methylbenzamide
CID 60565957
3-amino-4-(4-ethoxyphenoxy)-N-methylbenzamide
CID 82992417
4-methyl-3-(2-methylpropoxy)benzohydrazide
CID 163359289
2-(4-ethoxy-2,5-dimethylphenyl)-N-methyl-2-oxoacetamide
CID 82116584
N-[2-chloro-5-(methylcarbamoyl)phenyl]-4-ethoxy-3-methoxybenzamide
CID 87004486
N-(3-chloro-4-methylphenyl)-4-ethoxy-3-methoxybenzamide
CID 3894156
N'-[2-(2-ethoxyphenoxy)acetyl]-3,4-dimethylbenzohydrazide
CID 2102668

Frequently Asked Questions

What is the IUPAC name of 3-ethoxy-N,4-dimethylbenzamide?
The IUPAC name of 3-ethoxy-N,4-dimethylbenzamide (CID 59678322) is 3-ethoxy-N,4-dimethylbenzamide.
What is the SMILES notation for 3-ethoxy-N,4-dimethylbenzamide?
The canonical SMILES for 3-ethoxy-N,4-dimethylbenzamide is CCOc1cc(C(=O)NC)ccc1C.
What is the InChIKey of 3-ethoxy-N,4-dimethylbenzamide?
The InChIKey is KKFDCEKDRVECGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NO2/c1-4-14-10-7-9(11(13)12-3)6-5-8(10)2/h5-7H,4H2,1-3H3,(H,12,13).
What are the key properties of 3-ethoxy-N,4-dimethylbenzamide?
3-ethoxy-N,4-dimethylbenzamide has a molecular weight of 193.25 g/mol, XLogP of 1.75, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethoxy-N,4-dimethylbenzamide is sourced from PubChem (CID 59678322), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).