N-(3-acetylphenyl)-2-(3,4,5-trimethoxyphenyl)acetamide

C19H21NO5 — CID 2406485

IUPACN-(3-acetylphenyl)-2-(3,4,5-trimethoxyphenyl)acetamide
SMILESCOc1cc(CC(=O)Nc2cccc(C(C)=O)c2)cc(OC)c1OC
InChIInChI=1S/C19H21NO5/c1-12(21)14-6-5-7-15(11-14)20-18(22)10-13-8-16(23-2)19(25-4)17(9-13)24-3/h5-9,11H,10H2,1-4H3,(H,20,22)
InChIKeyVSDSJNPJGCHCLB-UHFFFAOYSA-N
MW343.38 g/mol
LogP3.10
Rot. Bonds7

About N-(3-acetylphenyl)-2-(3,4,5-trimethoxyphenyl)acetamide

N-(3-acetylphenyl)-2-(3,4,5-trimethoxyphenyl)acetamide (PubChem CID 2406485) has the molecular formula C19H21NO5 and a molecular weight of 343.38 g/mol. Its IUPAC name is N-(3-acetylphenyl)-2-(3,4,5-trimethoxyphenyl)acetamide.

Molecular Properties

Compound NameN-(3-acetylphenyl)-2-(3,4,5-trimethoxyphenyl)acetamide
PubChem CID2406485
Molecular FormulaC19H21NO5
Molecular Weight343.38 g/mol
Exact Mass343.14
IUPAC NameN-(3-acetylphenyl)-2-(3,4,5-trimethoxyphenyl)acetamide
SMILESCOc1cc(CC(=O)Nc2cccc(C(C)=O)c2)cc(OC)c1OC
InChIInChI=1S/C19H21NO5/c1-12(21)14-6-5-7-15(11-14)20-18(22)10-13-8-16(23-2)19(25-4)17(9-13)24-3/h5-9,11H,10H2,1-4H3,(H,20,22)
InChIKeyVSDSJNPJGCHCLB-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

N-(4-acetylphenyl)-2-(3,4,5-trimethoxyphenyl)acetamide
CID 2597337
N-[3-[[2-(3,4,5-trimethoxyphenyl)acetyl]amino]phenyl]propanamide
CID 39991372
N-(3-iodophenyl)-2-(3,4,5-trimethoxyphenyl)acetamide
CID 26517733
2-[3-[[2-(3,4,5-trimethoxyphenyl)acetyl]amino]phenyl]acetic acid
CID 119351773
[(2S)-1-(3-acetylanilino)-1-oxopropan-2-yl] 2-(3,4,5-trimethoxyphenyl)acetate
CID 7706284
N-(3-acetylphenyl)-2-(2-methoxyphenyl)acetamide
CID 2711452
2,2-dimethyl-N-[3-[[2-(3,4,5-trimethoxyphenyl)acetyl]amino]phenyl]propanamide
CID 30671146
N-(4-acetamidophenyl)-2-(3,4,5-trimethoxyphenyl)acetamide
CID 4884121
N-(3-acetylphenyl)-2-(2-methoxy-4,5-dimethylphenyl)acetamide
CID 110767948
N-[3-(difluoromethoxy)phenyl]-2-(3,4,5-trimethoxyphenyl)acetamide
CID 55742320
N-pyridin-4-yl-2-(3,4,5-trimethoxyphenyl)acetamide
CID 27700068
N-(3-acetylphenyl)-2-(4-methoxy-2,5-dimethylphenyl)acetamide
CID 110768011

Frequently Asked Questions

What is the IUPAC name of N-(3-acetylphenyl)-2-(3,4,5-trimethoxyphenyl)acetamide?
The IUPAC name of N-(3-acetylphenyl)-2-(3,4,5-trimethoxyphenyl)acetamide (CID 2406485) is N-(3-acetylphenyl)-2-(3,4,5-trimethoxyphenyl)acetamide.
What is the SMILES notation for N-(3-acetylphenyl)-2-(3,4,5-trimethoxyphenyl)acetamide?
The canonical SMILES for N-(3-acetylphenyl)-2-(3,4,5-trimethoxyphenyl)acetamide is COc1cc(CC(=O)Nc2cccc(C(C)=O)c2)cc(OC)c1OC.
What is the InChIKey of N-(3-acetylphenyl)-2-(3,4,5-trimethoxyphenyl)acetamide?
The InChIKey is VSDSJNPJGCHCLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21NO5/c1-12(21)14-6-5-7-15(11-14)20-18(22)10-13-8-16(23-2)19(25-4)17(9-13)24-3/h5-9,11H,10H2,1-4H3,(H,20,22).
What are the key properties of N-(3-acetylphenyl)-2-(3,4,5-trimethoxyphenyl)acetamide?
N-(3-acetylphenyl)-2-(3,4,5-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-(3-acetylphenyl)-2-(3,4,5-trimethoxyphenyl)acetamide is sourced from PubChem (CID 2406485), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).