3-acetamido-N-(4-phenoxyphenyl)benzamide

C21H18N2O3 — CID 24639214

IUPAC3-acetamido-N-(4-phenoxyphenyl)benzamide
SMILESCC(=O)Nc1cccc(C(=O)Nc2ccc(Oc3ccccc3)cc2)c1
InChIInChI=1S/C21H18N2O3/c1-15(24)22-18-7-5-6-16(14-18)21(25)23-17-10-12-20(13-11-17)26-19-8-3-2-4-9-19/h2-14H,1H3,(H,22,24)(H,23,25)
InChIKeyCQYKCSUNEBJQIH-UHFFFAOYSA-N
MW346.39 g/mol
LogP4.69
Rot. Bonds5

About 3-acetamido-N-(4-phenoxyphenyl)benzamide

3-acetamido-N-(4-phenoxyphenyl)benzamide (PubChem CID 24639214) has the molecular formula C21H18N2O3 and a molecular weight of 346.39 g/mol. Its IUPAC name is 3-acetamido-N-(4-phenoxyphenyl)benzamide.

Molecular Properties

Compound Name3-acetamido-N-(4-phenoxyphenyl)benzamide
PubChem CID24639214
Molecular FormulaC21H18N2O3
Molecular Weight346.39 g/mol
Exact Mass346.13
IUPAC Name3-acetamido-N-(4-phenoxyphenyl)benzamide
SMILESCC(=O)Nc1cccc(C(=O)Nc2ccc(Oc3ccccc3)cc2)c1
InChIInChI=1S/C21H18N2O3/c1-15(24)22-18-7-5-6-16(14-18)21(25)23-17-10-12-20(13-11-17)26-19-8-3-2-4-9-19/h2-14H,1H3,(H,22,24)(H,23,25)
InChIKeyCQYKCSUNEBJQIH-UHFFFAOYSA-N
XLogP4.69
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.39
LogP ≤ 54.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-acetamidophenyl)-3-phenoxybenzamide
CID 2483771
1-N,3-N-bis(4-phenoxyphenyl)benzene-1,3-dicarboxamide
CID 3090014
N-(4-acetamidophenyl)-4-phenoxybenzamide
CID 16651566
N-[3-[(4-phenoxyphenyl)carbamoyl]phenyl]pyridine-3-carboxamide
CID 55631172
N-(4-phenoxyphenyl)-3-propan-2-yloxybenzamide
CID 8779117
3-(cyclopropanecarbonylamino)-N-(4-phenoxyphenyl)benzamide
CID 34757379
N-(4-phenoxyphenyl)-3-phenylbenzamide
CID 117089120
3-acetamido-N-[4-[(2-methylpropan-2-yl)oxy]phenyl]benzamide
CID 110792701
3-acetamido-N-(4-ethoxyphenyl)benzamide
CID 17396899
phenoxybenzene;N-phenylacetamide
CID 174350344
N-(3-methylphenyl)-4-phenoxybenzamide
CID 7946520
N-(4-bromophenyl)-3-phenoxybenzamide
CID 1318843

Frequently Asked Questions

What is the IUPAC name of 3-acetamido-N-(4-phenoxyphenyl)benzamide?
The IUPAC name of 3-acetamido-N-(4-phenoxyphenyl)benzamide (CID 24639214) is 3-acetamido-N-(4-phenoxyphenyl)benzamide.
What is the SMILES notation for 3-acetamido-N-(4-phenoxyphenyl)benzamide?
The canonical SMILES for 3-acetamido-N-(4-phenoxyphenyl)benzamide is CC(=O)Nc1cccc(C(=O)Nc2ccc(Oc3ccccc3)cc2)c1.
What is the InChIKey of 3-acetamido-N-(4-phenoxyphenyl)benzamide?
The InChIKey is CQYKCSUNEBJQIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H18N2O3/c1-15(24)22-18-7-5-6-16(14-18)21(25)23-17-10-12-20(13-11-17)26-19-8-3-2-4-9-19/h2-14H,1H3,(H,22,24)(H,23,25).
What are the key properties of 3-acetamido-N-(4-phenoxyphenyl)benzamide?
3-acetamido-N-(4-phenoxyphenyl)benzamide has a molecular weight of 346.39 g/mol, XLogP of 4.69, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-acetamido-N-(4-phenoxyphenyl)benzamide is sourced from PubChem (CID 24639214), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).