3-acetamido-N-phenylpropanamide

C11H14N2O2 — CID 7946185

IUPAC3-acetamido-N-phenylpropanamide
SMILESCC(=O)NCCC(=O)Nc1ccccc1
InChIInChI=1S/C11H14N2O2/c1-9(14)12-8-7-11(15)13-10-5-3-2-4-6-10/h2-6H,7-8H2,1H3,(H,12,14)(H,13,15)
InChIKeyRDDRZPGOOFLJHN-UHFFFAOYSA-N
MW206.25 g/mol
LogP1.15
Rot. Bonds4

About 3-acetamido-N-phenylpropanamide

3-acetamido-N-phenylpropanamide (PubChem CID 7946185) has the molecular formula C11H14N2O2 and a molecular weight of 206.25 g/mol. Its IUPAC name is 3-acetamido-N-phenylpropanamide.

Molecular Properties

Compound Name3-acetamido-N-phenylpropanamide
PubChem CID7946185
Molecular FormulaC11H14N2O2
Molecular Weight206.25 g/mol
Exact Mass206.11
IUPAC Name3-acetamido-N-phenylpropanamide
SMILESCC(=O)NCCC(=O)Nc1ccccc1
InChIInChI=1S/C11H14N2O2/c1-9(14)12-8-7-11(15)13-10-5-3-2-4-6-10/h2-6H,7-8H2,1H3,(H,12,14)(H,13,15)
InChIKeyRDDRZPGOOFLJHN-UHFFFAOYSA-N
XLogP1.15
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.25
LogP ≤ 51.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-acetamido-N-(3-methylphenyl)propanamide
CID 47097671
3-(phenylcarbamoylamino)-N-[4-(phenylcarbamoylamino)phenyl]propanamide
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3-acetamido-N-pyridin-3-ylpropanamide
CID 91801519
3-acetamido-N-(2-hydroxyphenyl)propanamide
CID 47110153
N-(3-anilino-3-oxopropyl)-3-(3,5-dimethylpyrazolidin-4-yl)propanamide
CID 134127269
1-amino-N-(3-anilino-3-oxopropyl)cyclopropane-1-carboxamide
CID 119785778
(2S)-N-(3-anilino-3-oxopropyl)-2-bromopentanamide
CID 40803155
3-acetamido-N-[4-(dimethylsulfamoyl)phenyl]propanamide
CID 2082690
3-oxo-N-phenylbutanamide
CID 161275903
3-fluoro-N-phenylpropanamide
CID 70366284
3-acetamido-N-[4-(azepan-1-yl)phenyl]propanamide
CID 17462050
3-acetamido-N-[4-(4-ethoxyphenoxy)phenyl]propanamide
CID 2117866

Frequently Asked Questions

What is the IUPAC name of 3-acetamido-N-phenylpropanamide?
The IUPAC name of 3-acetamido-N-phenylpropanamide (CID 7946185) is 3-acetamido-N-phenylpropanamide.
What is the SMILES notation for 3-acetamido-N-phenylpropanamide?
The canonical SMILES for 3-acetamido-N-phenylpropanamide is CC(=O)NCCC(=O)Nc1ccccc1.
What is the InChIKey of 3-acetamido-N-phenylpropanamide?
The InChIKey is RDDRZPGOOFLJHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N2O2/c1-9(14)12-8-7-11(15)13-10-5-3-2-4-6-10/h2-6H,7-8H2,1H3,(H,12,14)(H,13,15).
What are the key properties of 3-acetamido-N-phenylpropanamide?
3-acetamido-N-phenylpropanamide has a molecular weight of 206.25 g/mol, XLogP of 1.15, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-acetamido-N-phenylpropanamide is sourced from PubChem (CID 7946185), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).