3-acetamido-N-ethylbenzamide

C11H14N2O2 — CID 17230670

IUPAC3-acetamido-N-ethylbenzamide
SMILESCCNC(=O)c1cccc(NC(C)=O)c1
InChIInChI=1S/C11H14N2O2/c1-3-12-11(15)9-5-4-6-10(7-9)13-8(2)14/h4-7H,3H2,1-2H3,(H,12,15)(H,13,14)
InChIKeyMVSCAGRTQTVRIS-UHFFFAOYSA-N
MW206.24 g/mol
LogP1.39
Rot. Bonds3

About 3-acetamido-N-ethylbenzamide

3-acetamido-N-ethylbenzamide (PubChem CID 17230670) has the molecular formula C11H14N2O2 and a molecular weight of 206.24 g/mol. Its IUPAC name is 3-acetamido-N-ethylbenzamide.

Molecular Properties

Compound Name3-acetamido-N-ethylbenzamide
PubChem CID17230670
Molecular FormulaC11H14N2O2
Molecular Weight206.24 g/mol
Exact Mass206.11
IUPAC Name3-acetamido-N-ethylbenzamide
SMILESCCNC(=O)c1cccc(NC(C)=O)c1
InChIInChI=1S/C11H14N2O2/c1-3-12-11(15)9-5-4-6-10(7-9)13-8(2)14/h4-7H,3H2,1-2H3,(H,12,15)(H,13,14)
InChIKeyMVSCAGRTQTVRIS-UHFFFAOYSA-N
XLogP1.39
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.24
LogP ≤ 51.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-[(3-acetamidobenzoyl)amino]-N-ethyl-4-methylbenzamide
CID 131938377
3-acetamido-N-prop-2-ynylbenzamide
CID 30601137
3-acetamido-N-(2-amino-2-oxoethyl)benzamide
CID 47116875
methyl 4-[[3-(ethylcarbamoyl)phenyl]carbamoyl]benzoate
CID 17230817
N-ethyl-3-(2-methylpropylcarbamoylamino)benzamide
CID 47200674
N-ethyl-3-[[3-(methanesulfonamido)benzoyl]amino]benzamide
CID 18151214
2-[[3-(ethylcarbamoyl)phenyl]carbamoyl]benzoic acid
CID 17230631
3-N-(3-acetamidophenyl)-1-N-propylbenzene-1,3-dicarboxamide
CID 109050420
3-acetamido-N-(3-methylbutyl)benzamide
CID 17458569
N-[2-[(3-acetamidobenzoyl)amino]ethyl]-3,4-dimethylbenzamide
CID 108541876
3-acetamido-N-(3-aminopropyl)benzamide
CID 82335696
3-acetamido-N-(4-hydroxybutyl)benzamide
CID 106843063

Frequently Asked Questions

What is the IUPAC name of 3-acetamido-N-ethylbenzamide?
The IUPAC name of 3-acetamido-N-ethylbenzamide (CID 17230670) is 3-acetamido-N-ethylbenzamide.
What is the SMILES notation for 3-acetamido-N-ethylbenzamide?
The canonical SMILES for 3-acetamido-N-ethylbenzamide is CCNC(=O)c1cccc(NC(C)=O)c1.
What is the InChIKey of 3-acetamido-N-ethylbenzamide?
The InChIKey is MVSCAGRTQTVRIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N2O2/c1-3-12-11(15)9-5-4-6-10(7-9)13-8(2)14/h4-7H,3H2,1-2H3,(H,12,15)(H,13,14).
What are the key properties of 3-acetamido-N-ethylbenzamide?
3-acetamido-N-ethylbenzamide has a molecular weight of 206.24 g/mol, XLogP of 1.39, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-acetamido-N-ethylbenzamide is sourced from PubChem (CID 17230670), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).