N-(3,4-dimethoxyphenyl)-2-(2,4-dimethylquinolin-3-yl)acetamide

C21H22N2O3 — CID 26364618

IUPACN-(3,4-dimethoxyphenyl)-2-(2,4-dimethylquinolin-3-yl)acetamide
SMILESCOc1ccc(NC(=O)Cc2c(C)nc3ccccc3c2C)cc1OC
InChIInChI=1S/C21H22N2O3/c1-13-16-7-5-6-8-18(16)22-14(2)17(13)12-21(24)23-15-9-10-19(25-3)20(11-15)26-4/h5-11H,12H2,1-4H3,(H,23,24)
InChIKeyLTJIJVMWFDVNEI-UHFFFAOYSA-N
MW350.42 g/mol
LogP4.05
Rot. Bonds5

About N-(3,4-dimethoxyphenyl)-2-(2,4-dimethylquinolin-3-yl)acetamide

N-(3,4-dimethoxyphenyl)-2-(2,4-dimethylquinolin-3-yl)acetamide (PubChem CID 26364618) has the molecular formula C21H22N2O3 and a molecular weight of 350.42 g/mol. Its IUPAC name is N-(3,4-dimethoxyphenyl)-2-(2,4-dimethylquinolin-3-yl)acetamide.

Molecular Properties

Compound NameN-(3,4-dimethoxyphenyl)-2-(2,4-dimethylquinolin-3-yl)acetamide
PubChem CID26364618
Molecular FormulaC21H22N2O3
Molecular Weight350.42 g/mol
Exact Mass350.16
IUPAC NameN-(3,4-dimethoxyphenyl)-2-(2,4-dimethylquinolin-3-yl)acetamide
SMILESCOc1ccc(NC(=O)Cc2c(C)nc3ccccc3c2C)cc1OC
InChIInChI=1S/C21H22N2O3/c1-13-16-7-5-6-8-18(16)22-14(2)17(13)12-21(24)23-15-9-10-19(25-3)20(11-15)26-4/h5-11H,12H2,1-4H3,(H,23,24)
InChIKeyLTJIJVMWFDVNEI-UHFFFAOYSA-N
XLogP4.05
TPSA60.45 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.42
LogP ≤ 54.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(2,4-dimethylquinolin-3-yl)-N-[6-(2-methoxy-4-methylphenoxy)-3-pyridinyl]acetamide
CID 36551375
2-(2,4-dimethylquinolin-3-yl)-N-(4-iodophenyl)acetamide
CID 8886793
N-[3-[[2-(2,4-dimethylquinolin-3-yl)acetyl]amino]phenyl]-2,2-dimethylpropanamide
CID 55532542
2-(2,4-dimethylquinolin-3-yl)-N-quinolin-3-ylacetamide
CID 18146501
N-[3-(diethylsulfamoyl)-4-ethoxyphenyl]-2-(2,4-dimethylquinolin-3-yl)acetamide
CID 43000493
2-(2,4-dimethylquinolin-3-yl)-N-(3-ethynylphenyl)acetamide
CID 39230533
2-(2,4-dimethylquinolin-3-yl)-N-pyridin-3-ylacetamide
CID 32789123
N-(2-amino-2-oxoethyl)-3-[[2-(2,4-dimethylquinolin-3-yl)acetyl]amino]benzamide
CID 36561953
2-(2,4-dimethylquinolin-3-yl)-N-[3-(tetrazol-1-yl)phenyl]acetamide
CID 8852353
2-(2,4-dimethylquinolin-3-yl)-N-(2-ethylphenyl)acetamide
CID 8839348
[2-(3,4-dimethoxyanilino)-2-oxoethyl] 2-methylquinoline-4-carboxylate
CID 2484633
N-(2-bromophenyl)-2-(2,4-dimethylquinolin-3-yl)acetamide
CID 31289097

Frequently Asked Questions

What is the IUPAC name of N-(3,4-dimethoxyphenyl)-2-(2,4-dimethylquinolin-3-yl)acetamide?
The IUPAC name of N-(3,4-dimethoxyphenyl)-2-(2,4-dimethylquinolin-3-yl)acetamide (CID 26364618) is N-(3,4-dimethoxyphenyl)-2-(2,4-dimethylquinolin-3-yl)acetamide.
What is the SMILES notation for N-(3,4-dimethoxyphenyl)-2-(2,4-dimethylquinolin-3-yl)acetamide?
The canonical SMILES for N-(3,4-dimethoxyphenyl)-2-(2,4-dimethylquinolin-3-yl)acetamide is COc1ccc(NC(=O)Cc2c(C)nc3ccccc3c2C)cc1OC.
What is the InChIKey of N-(3,4-dimethoxyphenyl)-2-(2,4-dimethylquinolin-3-yl)acetamide?
The InChIKey is LTJIJVMWFDVNEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H22N2O3/c1-13-16-7-5-6-8-18(16)22-14(2)17(13)12-21(24)23-15-9-10-19(25-3)20(11-15)26-4/h5-11H,12H2,1-4H3,(H,23,24).
What are the key properties of N-(3,4-dimethoxyphenyl)-2-(2,4-dimethylquinolin-3-yl)acetamide?
N-(3,4-dimethoxyphenyl)-2-(2,4-dimethylquinolin-3-yl)acetamide has a molecular weight of 350.42 g/mol, XLogP of 4.05, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,4-dimethoxyphenyl)-2-(2,4-dimethylquinolin-3-yl)acetamide is sourced from PubChem (CID 26364618), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).