2-ethyl-N-(2-oxopropyl)benzamide

C12H15NO2 — CID 22084530

IUPAC2-ethyl-N-(2-oxopropyl)benzamide
SMILESCCc1ccccc1C(=O)NCC(C)=O
InChIInChI=1S/C12H15NO2/c1-3-10-6-4-5-7-11(10)12(15)13-8-9(2)14/h4-7H,3,8H2,1-2H3,(H,13,15)
InChIKeyRKTGISZBYBYFDI-UHFFFAOYSA-N
MW205.26 g/mol
LogP1.57
Rot. Bonds4

About 2-ethyl-N-(2-oxopropyl)benzamide

2-ethyl-N-(2-oxopropyl)benzamide (PubChem CID 22084530) has the molecular formula C12H15NO2 and a molecular weight of 205.26 g/mol. Its IUPAC name is 2-ethyl-N-(2-oxopropyl)benzamide.

Molecular Properties

Compound Name2-ethyl-N-(2-oxopropyl)benzamide
PubChem CID22084530
Molecular FormulaC12H15NO2
Molecular Weight205.26 g/mol
Exact Mass205.11
IUPAC Name2-ethyl-N-(2-oxopropyl)benzamide
SMILESCCc1ccccc1C(=O)NCC(C)=O
InChIInChI=1S/C12H15NO2/c1-3-10-6-4-5-7-11(10)12(15)13-8-9(2)14/h4-7H,3,8H2,1-2H3,(H,13,15)
InChIKeyRKTGISZBYBYFDI-UHFFFAOYSA-N
XLogP1.57
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.26
LogP ≤ 51.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-oxopropyl)-2-(trifluoromethyl)benzamide
CID 64997392
2-ethyl-N-(6-hydroxyhexyl)benzamide
CID 103918854
N-(3,3-difluoro-2-hydroxypropyl)-2-ethylbenzamide
CID 103820546
3-[(2-ethylbenzoyl)amino]-2-methyl-2-phenylpropanoic acid
CID 120701661
2-ethyl-N-pent-4-ynylbenzamide
CID 103816602
2-ethyl-N-(4-hydroxypentyl)benzamide
CID 107300304
ethyl 3-[(2-ethylbenzoyl)amino]propanoate
CID 70914012
2-(2-chlorophenyl)-N-(2-oxopropyl)acetamide
CID 64996556
2-[[2-(aminomethyl)benzoyl]amino]acetic acid
CID 57129733
1-[[(2-ethylbenzoyl)amino]methyl]cyclopentane-1-carboxylic acid
CID 115432966
methylphosphane;N-(2-oxopropyl)-2-phenylacetamide
CID 161423403
2-ethyl-N-(4-methylphenyl)benzamide
CID 20613365

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-N-(2-oxopropyl)benzamide?
The IUPAC name of 2-ethyl-N-(2-oxopropyl)benzamide (CID 22084530) is 2-ethyl-N-(2-oxopropyl)benzamide.
What is the SMILES notation for 2-ethyl-N-(2-oxopropyl)benzamide?
The canonical SMILES for 2-ethyl-N-(2-oxopropyl)benzamide is CCc1ccccc1C(=O)NCC(C)=O.
What is the InChIKey of 2-ethyl-N-(2-oxopropyl)benzamide?
The InChIKey is RKTGISZBYBYFDI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15NO2/c1-3-10-6-4-5-7-11(10)12(15)13-8-9(2)14/h4-7H,3,8H2,1-2H3,(H,13,15).
What are the key properties of 2-ethyl-N-(2-oxopropyl)benzamide?
2-ethyl-N-(2-oxopropyl)benzamide has a molecular weight of 205.26 g/mol, XLogP of 1.57, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-N-(2-oxopropyl)benzamide is sourced from PubChem (CID 22084530), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).