3-(3-acetylphenyl)-N-[2-(4-hydroxyphenyl)ethyl]benzamide

C23H21NO3 — CID 117084824

IUPAC3-(3-acetylphenyl)-N-[2-(4-hydroxyphenyl)ethyl]benzamide
SMILESCC(=O)c1cccc(-c2cccc(C(=O)NCCc3ccc(O)cc3)c2)c1
InChIInChI=1S/C23H21NO3/c1-16(25)18-4-2-5-19(14-18)20-6-3-7-21(15-20)23(27)24-13-12-17-8-10-22(26)11-9-17/h2-11,14-15,26H,12-13H2,1H3,(H,24,27)
InChIKeyFIJXDIWOCGUZKY-UHFFFAOYSA-N
MW359.43 g/mol
LogP4.23
Rot. Bonds6

About 3-(3-acetylphenyl)-N-[2-(4-hydroxyphenyl)ethyl]benzamide

3-(3-acetylphenyl)-N-[2-(4-hydroxyphenyl)ethyl]benzamide (PubChem CID 117084824) has the molecular formula C23H21NO3 and a molecular weight of 359.43 g/mol. Its IUPAC name is 3-(3-acetylphenyl)-N-[2-(4-hydroxyphenyl)ethyl]benzamide.

Molecular Properties

Compound Name3-(3-acetylphenyl)-N-[2-(4-hydroxyphenyl)ethyl]benzamide
PubChem CID117084824
Molecular FormulaC23H21NO3
Molecular Weight359.43 g/mol
Exact Mass359.15
IUPAC Name3-(3-acetylphenyl)-N-[2-(4-hydroxyphenyl)ethyl]benzamide
SMILESCC(=O)c1cccc(-c2cccc(C(=O)NCCc3ccc(O)cc3)c2)c1
InChIInChI=1S/C23H21NO3/c1-16(25)18-4-2-5-19(14-18)20-6-3-7-21(15-20)23(27)24-13-12-17-8-10-22(26)11-9-17/h2-11,14-15,26H,12-13H2,1H3,(H,24,27)
InChIKeyFIJXDIWOCGUZKY-UHFFFAOYSA-N
XLogP4.23
TPSA66.40 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.43
LogP ≤ 54.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(4-methoxyphenyl)ethyl]-3-phenylbenzamide
CID 117087730
3-N-(3-acetylphenyl)-1-N-(2-phenylethyl)benzene-1,3-dicarboxamide
CID 109055307
3-hydroxy-N-[2-(4-hydroxyphenyl)ethyl]-4-methylbenzamide
CID 61017535
1-[3-[4-[2-(4-hydroxyphenyl)ethylamino]pyrimidin-2-yl]phenyl]ethanone
CID 117086561
N-[2-(4-hydroxyphenyl)ethyl]naphthalene-2-carboxamide
CID 6624490
1-N,3-N-bis[2-(4-chlorophenyl)ethyl]benzene-1,3-dicarboxamide
CID 1242332
N-[2-(4-hydroxyphenyl)ethyl]-1-methylpyridin-1-ium-3-carboxamide
CID 3578527
N-[3-[2-(4-hydroxyphenyl)ethylamino]-3-oxopropyl]benzamide
CID 172913635
3-(2,6-dichlorophenyl)-N-(2-phenylethyl)benzamide
CID 86048215
1-[4-(4-acetylphenyl)phenyl]ethanone;4-(4-acetylphenyl)-N-(2-phenylethyl)benzamide
CID 91489702
3-hydroxy-N-[2-(3-methylphenyl)ethyl]benzamide
CID 62313945
N-[2-(3-chlorophenyl)ethyl]-3-[3-(hydroxycarbamoyl)phenyl]benzamide
CID 25255713

Frequently Asked Questions

What is the IUPAC name of 3-(3-acetylphenyl)-N-[2-(4-hydroxyphenyl)ethyl]benzamide?
The IUPAC name of 3-(3-acetylphenyl)-N-[2-(4-hydroxyphenyl)ethyl]benzamide (CID 117084824) is 3-(3-acetylphenyl)-N-[2-(4-hydroxyphenyl)ethyl]benzamide.
What is the SMILES notation for 3-(3-acetylphenyl)-N-[2-(4-hydroxyphenyl)ethyl]benzamide?
The canonical SMILES for 3-(3-acetylphenyl)-N-[2-(4-hydroxyphenyl)ethyl]benzamide is CC(=O)c1cccc(-c2cccc(C(=O)NCCc3ccc(O)cc3)c2)c1.
What is the InChIKey of 3-(3-acetylphenyl)-N-[2-(4-hydroxyphenyl)ethyl]benzamide?
The InChIKey is FIJXDIWOCGUZKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H21NO3/c1-16(25)18-4-2-5-19(14-18)20-6-3-7-21(15-20)23(27)24-13-12-17-8-10-22(26)11-9-17/h2-11,14-15,26H,12-13H2,1H3,(H,24,27).
What are the key properties of 3-(3-acetylphenyl)-N-[2-(4-hydroxyphenyl)ethyl]benzamide?
3-(3-acetylphenyl)-N-[2-(4-hydroxyphenyl)ethyl]benzamide has a molecular weight of 359.43 g/mol, XLogP of 4.23, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-acetylphenyl)-N-[2-(4-hydroxyphenyl)ethyl]benzamide is sourced from PubChem (CID 117084824), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).