N-(2-acetylphenyl)-2-(2,3,4-trimethoxyphenyl)acetamide

C19H21NO5 — CID 18089670

IUPACN-(2-acetylphenyl)-2-(2,3,4-trimethoxyphenyl)acetamide
SMILESCOc1ccc(CC(=O)Nc2ccccc2C(C)=O)c(OC)c1OC
InChIInChI=1S/C19H21NO5/c1-12(21)14-7-5-6-8-15(14)20-17(22)11-13-9-10-16(23-2)19(25-4)18(13)24-3/h5-10H,11H2,1-4H3,(H,20,22)
InChIKeyPSSGAAMPSMDLCB-UHFFFAOYSA-N
MW343.38 g/mol
LogP3.10
Rot. Bonds7

About N-(2-acetylphenyl)-2-(2,3,4-trimethoxyphenyl)acetamide

N-(2-acetylphenyl)-2-(2,3,4-trimethoxyphenyl)acetamide (PubChem CID 18089670) has the molecular formula C19H21NO5 and a molecular weight of 343.38 g/mol. Its IUPAC name is N-(2-acetylphenyl)-2-(2,3,4-trimethoxyphenyl)acetamide.

Molecular Properties

Compound NameN-(2-acetylphenyl)-2-(2,3,4-trimethoxyphenyl)acetamide
PubChem CID18089670
Molecular FormulaC19H21NO5
Molecular Weight343.38 g/mol
Exact Mass343.14
IUPAC NameN-(2-acetylphenyl)-2-(2,3,4-trimethoxyphenyl)acetamide
SMILESCOc1ccc(CC(=O)Nc2ccccc2C(C)=O)c(OC)c1OC
InChIInChI=1S/C19H21NO5/c1-12(21)14-7-5-6-8-15(14)20-17(22)11-13-9-10-16(23-2)19(25-4)18(13)24-3/h5-10H,11H2,1-4H3,(H,20,22)
InChIKeyPSSGAAMPSMDLCB-UHFFFAOYSA-N
XLogP3.10
TPSA73.86 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.38
LogP ≤ 53.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-chloro-N'-[2-(2,3,4-trimethoxyphenyl)acetyl]benzohydrazide
CID 8870426
N-(5-chloro-2-methoxyphenyl)-2-(2,3,4-trimethoxyphenyl)acetamide
CID 17462179
N-[2-(ethylaminomethyl)phenyl]-3-(2,3,4-trimethoxyphenyl)propanamide
CID 119440825
1-[2-(2,3,4-trimethoxyphenyl)phenyl]ethanone
CID 61033108
N-[(2-chlorophenyl)methyl]-2-(2,3,4-trimethoxyphenyl)acetamide
CID 9079447
N-[2-(2-chloroanilino)-2-oxoethyl]-N-methyl-2-(2,3,4-trimethoxyphenyl)acetamide
CID 9090069
hydroxymethyl 2-[5-[2-[[2-(2,3,4-trimethoxyphenyl)acetyl]amino]phenyl]thiophen-2-yl]acetate
CID 58318525
N-[(2,3,4-trimethoxyphenyl)methyl]acetamide
CID 18425632
4-[[2-(2,3,4-trimethoxyphenyl)acetyl]amino]benzamide
CID 17463761
N-(2-acetylphenyl)-3,4-dimethoxybenzamide
CID 17394178
[2-(2-acetylanilino)-2-oxoethyl] (E)-3-(3,4,5-trimethoxyphenyl)prop-2-enoate
CID 2503702
2-bromo-N-[(2,3,4-trimethoxyphenyl)methyl]benzamide
CID 46591375

Frequently Asked Questions

What is the IUPAC name of N-(2-acetylphenyl)-2-(2,3,4-trimethoxyphenyl)acetamide?
The IUPAC name of N-(2-acetylphenyl)-2-(2,3,4-trimethoxyphenyl)acetamide (CID 18089670) is N-(2-acetylphenyl)-2-(2,3,4-trimethoxyphenyl)acetamide.
What is the SMILES notation for N-(2-acetylphenyl)-2-(2,3,4-trimethoxyphenyl)acetamide?
The canonical SMILES for N-(2-acetylphenyl)-2-(2,3,4-trimethoxyphenyl)acetamide is COc1ccc(CC(=O)Nc2ccccc2C(C)=O)c(OC)c1OC.
What is the InChIKey of N-(2-acetylphenyl)-2-(2,3,4-trimethoxyphenyl)acetamide?
The InChIKey is PSSGAAMPSMDLCB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21NO5/c1-12(21)14-7-5-6-8-15(14)20-17(22)11-13-9-10-16(23-2)19(25-4)18(13)24-3/h5-10H,11H2,1-4H3,(H,20,22).
What are the key properties of N-(2-acetylphenyl)-2-(2,3,4-trimethoxyphenyl)acetamide?
N-(2-acetylphenyl)-2-(2,3,4-trimethoxyphenyl)acetamide has a molecular weight of 343.38 g/mol, XLogP of 3.10, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-acetylphenyl)-2-(2,3,4-trimethoxyphenyl)acetamide is sourced from PubChem (CID 18089670), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).