3-ethoxy-N-(3-hydroxyphenyl)-4-phenylmethoxybenzamide

C22H21NO4 — CID 126089788

IUPAC3-ethoxy-N-(3-hydroxyphenyl)-4-phenylmethoxybenzamide
SMILESCCOc1cc(C(=O)Nc2cccc(O)c2)ccc1OCc1ccccc1
InChIInChI=1S/C22H21NO4/c1-2-26-21-13-17(22(25)23-18-9-6-10-19(24)14-18)11-12-20(21)27-15-16-7-4-3-5-8-16/h3-14,24H,2,15H2,1H3,(H,23,25)
InChIKeyOIILMRWAKRUVPB-UHFFFAOYSA-N
MW363.41 g/mol
LogP4.62
Rot. Bonds7

About 3-ethoxy-N-(3-hydroxyphenyl)-4-phenylmethoxybenzamide

3-ethoxy-N-(3-hydroxyphenyl)-4-phenylmethoxybenzamide (PubChem CID 126089788) has the molecular formula C22H21NO4 and a molecular weight of 363.41 g/mol. Its IUPAC name is 3-ethoxy-N-(3-hydroxyphenyl)-4-phenylmethoxybenzamide.

Molecular Properties

Compound Name3-ethoxy-N-(3-hydroxyphenyl)-4-phenylmethoxybenzamide
PubChem CID126089788
Molecular FormulaC22H21NO4
Molecular Weight363.41 g/mol
Exact Mass363.15
IUPAC Name3-ethoxy-N-(3-hydroxyphenyl)-4-phenylmethoxybenzamide
SMILESCCOc1cc(C(=O)Nc2cccc(O)c2)ccc1OCc1ccccc1
InChIInChI=1S/C22H21NO4/c1-2-26-21-13-17(22(25)23-18-9-6-10-19(24)14-18)11-12-20(21)27-15-16-7-4-3-5-8-16/h3-14,24H,2,15H2,1H3,(H,23,25)
InChIKeyOIILMRWAKRUVPB-UHFFFAOYSA-N
XLogP4.62
TPSA67.79 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.41
LogP ≤ 54.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3-chlorophenyl)-3-ethoxy-4-phenylmethoxybenzamide
CID 2192184
4-ethoxy-3-phenylmethoxy-N-[3-(trifluoromethyl)phenyl]benzamide
CID 5002030
3-ethoxy-N-(4-methylphenyl)-4-phenylmethoxybenzamide
CID 126086097
N-[3-(aminomethyl)phenyl]-3,4-diethoxybenzamide
CID 16778324
3-methoxy-N-phenyl-4-phenylmethoxybenzamide
CID 5161412
3-ethoxy-N-(3-iodophenyl)-4-[(4-methylphenyl)methoxy]benzamide
CID 3328427
3-ethoxy-N-[(E)-(3-hydroxyphenyl)methylideneamino]-4-phenylmethoxybenzamide
CID 126320551
N-benzyl-3-ethoxy-4-phenylmethoxybenzamide
CID 2192321
3-ethoxy-N-(2-methoxyphenyl)-4-phenylmethoxybenzamide
CID 126087524
3,4-diethoxy-N-[3-(pyridin-3-ylmethoxy)phenyl]benzamide
CID 60520684
3-ethoxy-N-(3-fluorophenyl)-4-(pyridin-3-ylmethoxy)benzamide
CID 39111619
4-ethoxy-3-methyl-N-(4-phenylmethoxyphenyl)benzamide
CID 30147613

Frequently Asked Questions

What is the IUPAC name of 3-ethoxy-N-(3-hydroxyphenyl)-4-phenylmethoxybenzamide?
The IUPAC name of 3-ethoxy-N-(3-hydroxyphenyl)-4-phenylmethoxybenzamide (CID 126089788) is 3-ethoxy-N-(3-hydroxyphenyl)-4-phenylmethoxybenzamide.
What is the SMILES notation for 3-ethoxy-N-(3-hydroxyphenyl)-4-phenylmethoxybenzamide?
The canonical SMILES for 3-ethoxy-N-(3-hydroxyphenyl)-4-phenylmethoxybenzamide is CCOc1cc(C(=O)Nc2cccc(O)c2)ccc1OCc1ccccc1.
What is the InChIKey of 3-ethoxy-N-(3-hydroxyphenyl)-4-phenylmethoxybenzamide?
The InChIKey is OIILMRWAKRUVPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H21NO4/c1-2-26-21-13-17(22(25)23-18-9-6-10-19(24)14-18)11-12-20(21)27-15-16-7-4-3-5-8-16/h3-14,24H,2,15H2,1H3,(H,23,25).
What are the key properties of 3-ethoxy-N-(3-hydroxyphenyl)-4-phenylmethoxybenzamide?
3-ethoxy-N-(3-hydroxyphenyl)-4-phenylmethoxybenzamide has a molecular weight of 363.41 g/mol, XLogP of 4.62, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethoxy-N-(3-hydroxyphenyl)-4-phenylmethoxybenzamide is sourced from PubChem (CID 126089788), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).