N-(5-acetyl-2-ethoxyphenyl)-2-methylbenzamide

C18H19NO3 — CID 82156333

IUPACN-(5-acetyl-2-ethoxyphenyl)-2-methylbenzamide
SMILESCCOc1ccc(C(C)=O)cc1NC(=O)c1ccccc1C
InChIInChI=1S/C18H19NO3/c1-4-22-17-10-9-14(13(3)20)11-16(17)19-18(21)15-8-6-5-7-12(15)2/h5-11H,4H2,1-3H3,(H,19,21)
InChIKeyGBLVLVZDXRZESU-UHFFFAOYSA-N
MW297.35 g/mol
LogP3.85
Rot. Bonds5

About N-(5-acetyl-2-ethoxyphenyl)-2-methylbenzamide

N-(5-acetyl-2-ethoxyphenyl)-2-methylbenzamide (PubChem CID 82156333) has the molecular formula C18H19NO3 and a molecular weight of 297.35 g/mol. Its IUPAC name is N-(5-acetyl-2-ethoxyphenyl)-2-methylbenzamide.

Molecular Properties

Compound NameN-(5-acetyl-2-ethoxyphenyl)-2-methylbenzamide
PubChem CID82156333
Molecular FormulaC18H19NO3
Molecular Weight297.35 g/mol
Exact Mass297.14
IUPAC NameN-(5-acetyl-2-ethoxyphenyl)-2-methylbenzamide
SMILESCCOc1ccc(C(C)=O)cc1NC(=O)c1ccccc1C
InChIInChI=1S/C18H19NO3/c1-4-22-17-10-9-14(13(3)20)11-16(17)19-18(21)15-8-6-5-7-12(15)2/h5-11H,4H2,1-3H3,(H,19,21)
InChIKeyGBLVLVZDXRZESU-UHFFFAOYSA-N
XLogP3.85
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.35
LogP ≤ 53.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

methyl 2-[(5-acetyl-2-ethoxyphenyl)carbamoyl]benzoate
CID 118626412
3-N-(5-acetyl-2-ethoxyphenyl)-1-N-hydroxy-4-methylbenzene-1,3-dicarboxamide
CID 164620621
N-(4-benzamido-2,5-diethoxyphenyl)-2-methylbenzamide
CID 1051986
N-(3,4-diethoxyphenyl)-2-methylbenzamide
CID 26212680
N-(5-acetyl-2-ethoxyphenyl)-3-chlorobenzamide
CID 94763103
2-[(5-acetyl-2-ethoxybenzoyl)amino]-3-methylbenzamide
CID 18536582
3-[(2-ethoxybenzoyl)amino]-4-methylbenzoic acid
CID 16789136
N-(5-acetyl-2-ethoxyphenyl)-2,2,2-trifluoroacetamide
CID 82156351
N-(2,5-diethoxyphenyl)-2-ethoxybenzamide
CID 43000684
N-(3-acetylphenyl)-2-ethoxybenzamide
CID 773754
N-(5-acetyl-2-ethoxyphenyl)cyclopropanecarboxamide
CID 82156326
5-amino-N-[5-(dimethylcarbamoyl)-2-ethoxyphenyl]-2-methylbenzamide
CID 120638221

Frequently Asked Questions

What is the IUPAC name of N-(5-acetyl-2-ethoxyphenyl)-2-methylbenzamide?
The IUPAC name of N-(5-acetyl-2-ethoxyphenyl)-2-methylbenzamide (CID 82156333) is N-(5-acetyl-2-ethoxyphenyl)-2-methylbenzamide.
What is the SMILES notation for N-(5-acetyl-2-ethoxyphenyl)-2-methylbenzamide?
The canonical SMILES for N-(5-acetyl-2-ethoxyphenyl)-2-methylbenzamide is CCOc1ccc(C(C)=O)cc1NC(=O)c1ccccc1C.
What is the InChIKey of N-(5-acetyl-2-ethoxyphenyl)-2-methylbenzamide?
The InChIKey is GBLVLVZDXRZESU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19NO3/c1-4-22-17-10-9-14(13(3)20)11-16(17)19-18(21)15-8-6-5-7-12(15)2/h5-11H,4H2,1-3H3,(H,19,21).
What are the key properties of N-(5-acetyl-2-ethoxyphenyl)-2-methylbenzamide?
N-(5-acetyl-2-ethoxyphenyl)-2-methylbenzamide has a molecular weight of 297.35 g/mol, XLogP of 3.85, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-acetyl-2-ethoxyphenyl)-2-methylbenzamide is sourced from PubChem (CID 82156333), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).