N-(3-acetylphenyl)-2-[benzyl(cyclohexyl)amino]acetamide

C23H28N2O2 — CID 52688849

IUPACN-(3-acetylphenyl)-2-[benzyl(cyclohexyl)amino]acetamide
SMILESCC(=O)c1cccc(NC(=O)CN(Cc2ccccc2)C2CCCCC2)c1
InChIInChI=1S/C23H28N2O2/c1-18(26)20-11-8-12-21(15-20)24-23(27)17-25(22-13-6-3-7-14-22)16-19-9-4-2-5-10-19/h2,4-5,8-12,15,22H,3,6-7,13-14,16-17H2,1H3,(H,24,27)
InChIKeyUGISCSNDLICCED-UHFFFAOYSA-N
MW364.49 g/mol
LogP4.66
Rot. Bonds7

About N-(3-acetylphenyl)-2-[benzyl(cyclohexyl)amino]acetamide

N-(3-acetylphenyl)-2-[benzyl(cyclohexyl)amino]acetamide (PubChem CID 52688849) has the molecular formula C23H28N2O2 and a molecular weight of 364.49 g/mol. Its IUPAC name is N-(3-acetylphenyl)-2-[benzyl(cyclohexyl)amino]acetamide.

Molecular Properties

Compound NameN-(3-acetylphenyl)-2-[benzyl(cyclohexyl)amino]acetamide
PubChem CID52688849
Molecular FormulaC23H28N2O2
Molecular Weight364.49 g/mol
Exact Mass364.22
IUPAC NameN-(3-acetylphenyl)-2-[benzyl(cyclohexyl)amino]acetamide
SMILESCC(=O)c1cccc(NC(=O)CN(Cc2ccccc2)C2CCCCC2)c1
InChIInChI=1S/C23H28N2O2/c1-18(26)20-11-8-12-21(15-20)24-23(27)17-25(22-13-6-3-7-14-22)16-19-9-4-2-5-10-19/h2,4-5,8-12,15,22H,3,6-7,13-14,16-17H2,1H3,(H,24,27)
InChIKeyUGISCSNDLICCED-UHFFFAOYSA-N
XLogP4.66
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.49
LogP ≤ 54.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-[[2-[benzyl(cyclopropyl)amino]acetyl]amino]-N-methylbenzamide
CID 46643223
3-[acetyl(cycloheptyl)amino]-N-(3-acetylphenyl)propanamide
CID 113122753
3-[[2-[cyclopropyl-[(4-fluorophenyl)methyl]amino]acetyl]amino]-N-methylbenzamide
CID 8906749
3-[[2-[(4-carbamoylphenyl)methyl-cyclopropylamino]acetyl]amino]-N-methylbenzamide
CID 46568152
2-[benzyl(cyclohexyl)amino]-N-cyclopropylacetamide
CID 60522706
N-(3-acetamidophenyl)-2-[cyclopropyl-[(4-methoxyphenyl)methyl]amino]acetamide
CID 86908948
2-[cycloheptyl(methyl)amino]-N-phenylacetamide
CID 16577724
2-[acetyl(cyclohexyl)amino]-N-(3-bromophenyl)acetamide
CID 113159568
N-[3-(aminomethyl)phenyl]-2-[cyclohexyl(methyl)amino]acetamide
CID 16782283
2-[cyclohexyl-[2-oxo-2-[3-(trifluoromethyl)anilino]ethyl]amino]-N-[3-(trifluoromethyl)phenyl]acetamide
CID 1132545
N-(3-acetylphenyl)-2-[(4-bromophenyl)sulfonyl-cyclohexylamino]acetamide
CID 1321078
N-(3-acetylphenyl)-2-[methyl-[(1S,2R)-2-methylsulfanylcyclopentyl]amino]acetamide
CID 98775402

Frequently Asked Questions

What is the IUPAC name of N-(3-acetylphenyl)-2-[benzyl(cyclohexyl)amino]acetamide?
The IUPAC name of N-(3-acetylphenyl)-2-[benzyl(cyclohexyl)amino]acetamide (CID 52688849) is N-(3-acetylphenyl)-2-[benzyl(cyclohexyl)amino]acetamide.
What is the SMILES notation for N-(3-acetylphenyl)-2-[benzyl(cyclohexyl)amino]acetamide?
The canonical SMILES for N-(3-acetylphenyl)-2-[benzyl(cyclohexyl)amino]acetamide is CC(=O)c1cccc(NC(=O)CN(Cc2ccccc2)C2CCCCC2)c1.
What is the InChIKey of N-(3-acetylphenyl)-2-[benzyl(cyclohexyl)amino]acetamide?
The InChIKey is UGISCSNDLICCED-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H28N2O2/c1-18(26)20-11-8-12-21(15-20)24-23(27)17-25(22-13-6-3-7-14-22)16-19-9-4-2-5-10-19/h2,4-5,8-12,15,22H,3,6-7,13-14,16-17H2,1H3,(H,24,27).
What are the key properties of N-(3-acetylphenyl)-2-[benzyl(cyclohexyl)amino]acetamide?
N-(3-acetylphenyl)-2-[benzyl(cyclohexyl)amino]acetamide has a molecular weight of 364.49 g/mol, XLogP of 4.66, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-acetylphenyl)-2-[benzyl(cyclohexyl)amino]acetamide is sourced from PubChem (CID 52688849), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).