N-(4-acetamidophenyl)-2-[acetyl(2-phenylethyl)amino]acetamide

C20H23N3O3 — CID 113164087

IUPACN-(4-acetamidophenyl)-2-[acetyl(2-phenylethyl)amino]acetamide
SMILESCC(=O)Nc1ccc(NC(=O)CN(CCc2ccccc2)C(C)=O)cc1
InChIInChI=1S/C20H23N3O3/c1-15(24)21-18-8-10-19(11-9-18)22-20(26)14-23(16(2)25)13-12-17-6-4-3-5-7-17/h3-11H,12-14H2,1-2H3,(H,21,24)(H,22,26)
InChIKeyHNOSWQYYCKWHJJ-UHFFFAOYSA-N
MW353.42 g/mol
LogP2.67
Rot. Bonds7

About N-(4-acetamidophenyl)-2-[acetyl(2-phenylethyl)amino]acetamide

N-(4-acetamidophenyl)-2-[acetyl(2-phenylethyl)amino]acetamide (PubChem CID 113164087) has the molecular formula C20H23N3O3 and a molecular weight of 353.42 g/mol. Its IUPAC name is N-(4-acetamidophenyl)-2-[acetyl(2-phenylethyl)amino]acetamide.

Molecular Properties

Compound NameN-(4-acetamidophenyl)-2-[acetyl(2-phenylethyl)amino]acetamide
PubChem CID113164087
Molecular FormulaC20H23N3O3
Molecular Weight353.42 g/mol
Exact Mass353.17
IUPAC NameN-(4-acetamidophenyl)-2-[acetyl(2-phenylethyl)amino]acetamide
SMILESCC(=O)Nc1ccc(NC(=O)CN(CCc2ccccc2)C(C)=O)cc1
InChIInChI=1S/C20H23N3O3/c1-15(24)21-18-8-10-19(11-9-18)22-20(26)14-23(16(2)25)13-12-17-6-4-3-5-7-17/h3-11H,12-14H2,1-2H3,(H,21,24)(H,22,26)
InChIKeyHNOSWQYYCKWHJJ-UHFFFAOYSA-N
XLogP2.67
TPSA78.51 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.42
LogP ≤ 52.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-acetylphenyl)-2-[acetyl(3-phenylpropyl)amino]acetamide
CID 113165901
2-[acetyl(3-phenylpropyl)amino]-N-(4-cyanophenyl)acetamide
CID 113165933
methyl 3-[[2-[acetyl(2-phenylethyl)amino]acetyl]amino]benzoate
CID 113164089
3-[acetyl(2-phenylethyl)amino]-N-(4-ethylphenyl)propanamide
CID 113120822
2-[acetyl-[2-(4-fluorophenyl)ethyl]amino]-N-(4-ethylphenyl)acetamide
CID 113164399
3-[acetyl(2-phenylethyl)amino]-N-(4-chlorophenyl)propanamide
CID 113120836
2-[acetyl-[2-(dimethylamino)ethyl]amino]-N-phenylacetamide
CID 113160473
2-[acetyl(2-phenylethyl)amino]-N-(2,4-dimethylphenyl)acetamide
CID 113164038
2-[4-[[2-[acetyl(2-phenylethyl)amino]acetyl]amino]pyrazol-1-yl]-2-methylpropanoic acid
CID 120696902
2-[acetyl-[2-(4-fluorophenyl)ethyl]amino]-N-[4-(trifluoromethyl)phenyl]acetamide
CID 113164436
2-[acetyl-[2-(4-fluorophenyl)ethyl]amino]-N-[4-(diethylamino)phenyl]acetamide
CID 113164445
2-[acetyl(3-phenylpropyl)amino]-N-(3-bromophenyl)acetamide
CID 113165914

Frequently Asked Questions

What is the IUPAC name of N-(4-acetamidophenyl)-2-[acetyl(2-phenylethyl)amino]acetamide?
The IUPAC name of N-(4-acetamidophenyl)-2-[acetyl(2-phenylethyl)amino]acetamide (CID 113164087) is N-(4-acetamidophenyl)-2-[acetyl(2-phenylethyl)amino]acetamide.
What is the SMILES notation for N-(4-acetamidophenyl)-2-[acetyl(2-phenylethyl)amino]acetamide?
The canonical SMILES for N-(4-acetamidophenyl)-2-[acetyl(2-phenylethyl)amino]acetamide is CC(=O)Nc1ccc(NC(=O)CN(CCc2ccccc2)C(C)=O)cc1.
What is the InChIKey of N-(4-acetamidophenyl)-2-[acetyl(2-phenylethyl)amino]acetamide?
The InChIKey is HNOSWQYYCKWHJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23N3O3/c1-15(24)21-18-8-10-19(11-9-18)22-20(26)14-23(16(2)25)13-12-17-6-4-3-5-7-17/h3-11H,12-14H2,1-2H3,(H,21,24)(H,22,26).
What are the key properties of N-(4-acetamidophenyl)-2-[acetyl(2-phenylethyl)amino]acetamide?
N-(4-acetamidophenyl)-2-[acetyl(2-phenylethyl)amino]acetamide has a molecular weight of 353.42 g/mol, XLogP of 2.67, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-acetamidophenyl)-2-[acetyl(2-phenylethyl)amino]acetamide is sourced from PubChem (CID 113164087), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).