N-[2-[acetyl(1-phenylethyl)amino]ethyl]propanamide

C15H22N2O2 — CID 113054420

IUPACN-[2-[acetyl(1-phenylethyl)amino]ethyl]propanamide
SMILESCCC(=O)NCCN(C(C)=O)C(C)c1ccccc1
InChIInChI=1S/C15H22N2O2/c1-4-15(19)16-10-11-17(13(3)18)12(2)14-8-6-5-7-9-14/h5-9,12H,4,10-11H2,1-3H3,(H,16,19)
InChIKeyCBHJRCFEIBHUAB-UHFFFAOYSA-N
MW262.35 g/mol
LogP2.12
Rot. Bonds6

About N-[2-[acetyl(1-phenylethyl)amino]ethyl]propanamide

N-[2-[acetyl(1-phenylethyl)amino]ethyl]propanamide (PubChem CID 113054420) has the molecular formula C15H22N2O2 and a molecular weight of 262.35 g/mol. Its IUPAC name is N-[2-[acetyl(1-phenylethyl)amino]ethyl]propanamide.

Molecular Properties

Compound NameN-[2-[acetyl(1-phenylethyl)amino]ethyl]propanamide
PubChem CID113054420
Molecular FormulaC15H22N2O2
Molecular Weight262.35 g/mol
Exact Mass262.17
IUPAC NameN-[2-[acetyl(1-phenylethyl)amino]ethyl]propanamide
SMILESCCC(=O)NCCN(C(C)=O)C(C)c1ccccc1
InChIInChI=1S/C15H22N2O2/c1-4-15(19)16-10-11-17(13(3)18)12(2)14-8-6-5-7-9-14/h5-9,12H,4,10-11H2,1-3H3,(H,16,19)
InChIKeyCBHJRCFEIBHUAB-UHFFFAOYSA-N
XLogP2.12
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.35
LogP ≤ 52.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[acetyl(1-phenylethyl)amino]-N-propylacetamide
CID 113161938
N-(1-phenylethyl)-N-[2-(propylsulfonylamino)ethyl]acetamide
CID 113054490
N-[2-[acetyl(1-phenylethyl)amino]ethyl]-3,4-difluorobenzamide
CID 113054471
2-[acetyl(1-phenylethyl)amino]-N-[2-(4-fluorophenyl)ethyl]acetamide
CID 113161982
3-[1-phenylethyl(propanoyl)amino]propanoic acid
CID 82323265
N-[2-[acetyl(propan-2-yl)amino]ethyl]benzamide
CID 113051974
2-[acetyl(1-phenylethyl)amino]-N-cyclopropylacetamide
CID 113161940
1-phenylethyl(propyl)carbamic acid
CID 57360234
N-[[fluoro(dimethyl)silyl]methyl]-N-[(1S)-1-phenylethyl]acetamide
CID 101234105
N-[2-(dimethylamino)ethyl]-3,3-diphenylpropanamide
CID 2184828
N-(3-acetylphenyl)-3-[acetyl(1-phenylethyl)amino]propanamide
CID 113119025
3-[acetyl(1-phenylethyl)amino]-N-(2,3-dimethylphenyl)propanamide
CID 113118985

Frequently Asked Questions

What is the IUPAC name of N-[2-[acetyl(1-phenylethyl)amino]ethyl]propanamide?
The IUPAC name of N-[2-[acetyl(1-phenylethyl)amino]ethyl]propanamide (CID 113054420) is N-[2-[acetyl(1-phenylethyl)amino]ethyl]propanamide.
What is the SMILES notation for N-[2-[acetyl(1-phenylethyl)amino]ethyl]propanamide?
The canonical SMILES for N-[2-[acetyl(1-phenylethyl)amino]ethyl]propanamide is CCC(=O)NCCN(C(C)=O)C(C)c1ccccc1.
What is the InChIKey of N-[2-[acetyl(1-phenylethyl)amino]ethyl]propanamide?
The InChIKey is CBHJRCFEIBHUAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O2/c1-4-15(19)16-10-11-17(13(3)18)12(2)14-8-6-5-7-9-14/h5-9,12H,4,10-11H2,1-3H3,(H,16,19).
What are the key properties of N-[2-[acetyl(1-phenylethyl)amino]ethyl]propanamide?
N-[2-[acetyl(1-phenylethyl)amino]ethyl]propanamide has a molecular weight of 262.35 g/mol, XLogP of 2.12, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[acetyl(1-phenylethyl)amino]ethyl]propanamide is sourced from PubChem (CID 113054420), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).