7-methoxy-N-(2,4,6-trimethylphenyl)thieno[2,3-b]quinoline-2-carboxamide

C22H20N2O2S — CID 2093613

IUPAC7-methoxy-N-(2,4,6-trimethylphenyl)thieno[2,3-b]quinoline-2-carboxamide
SMILESCOc1ccc2cc3cc(C(=O)Nc4c(C)cc(C)cc4C)sc3nc2c1
InChIInChI=1S/C22H20N2O2S/c1-12-7-13(2)20(14(3)8-12)24-21(25)19-10-16-9-15-5-6-17(26-4)11-18(15)23-22(16)27-19/h5-11H,1-4H3,(H,24,25)
InChIKeyREIFWQVHLAIYSR-UHFFFAOYSA-N
MW376.48 g/mol
LogP5.64
Rot. Bonds3

About 7-methoxy-N-(2,4,6-trimethylphenyl)thieno[2,3-b]quinoline-2-carboxamide

7-methoxy-N-(2,4,6-trimethylphenyl)thieno[2,3-b]quinoline-2-carboxamide (PubChem CID 2093613) has the molecular formula C22H20N2O2S and a molecular weight of 376.48 g/mol. Its IUPAC name is 7-methoxy-N-(2,4,6-trimethylphenyl)thieno[2,3-b]quinoline-2-carboxamide.

Molecular Properties

Compound Name7-methoxy-N-(2,4,6-trimethylphenyl)thieno[2,3-b]quinoline-2-carboxamide
PubChem CID2093613
Molecular FormulaC22H20N2O2S
Molecular Weight376.48 g/mol
Exact Mass376.12
IUPAC Name7-methoxy-N-(2,4,6-trimethylphenyl)thieno[2,3-b]quinoline-2-carboxamide
SMILESCOc1ccc2cc3cc(C(=O)Nc4c(C)cc(C)cc4C)sc3nc2c1
InChIInChI=1S/C22H20N2O2S/c1-12-7-13(2)20(14(3)8-12)24-21(25)19-10-16-9-15-5-6-17(26-4)11-18(15)23-22(16)27-19/h5-11H,1-4H3,(H,24,25)
InChIKeyREIFWQVHLAIYSR-UHFFFAOYSA-N
XLogP5.64
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500376.48
LogP ≤ 55.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 7-methoxy-N-(2,4,6-trimethylphenyl)thieno[2,3-b]quinoline-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(2,5-dimethoxyphenyl)-7-methylthieno[2,3-b]quinoline-2-carboxamide
CID 15990436
6-methoxy-N-(5-methyl-1,2-oxazol-3-yl)thieno[2,3-b]quinoline-2-carboxamide
CID 5189392
N-(3,5-dimethoxyphenyl)-6-methylthieno[2,3-b]quinoline-2-carboxamide
CID 20966485
ethyl 4-[(7-methoxythieno[2,3-b]quinoline-2-carbonyl)amino]piperidine-1-carboxylate
CID 46249798
6-methoxy-N-[(5-methylfuran-2-yl)methyl]thieno[2,3-b]quinoline-2-carboxamide
CID 15995302
N-(3-methoxypropyl)-7-methylthieno[2,3-b]quinoline-2-carboxamide
CID 22434505
3-N-(4-methoxyphenyl)-5-N-(2,4,6-trimethylphenyl)pyridine-3,5-dicarboxamide
CID 109108631
3-amino-7-methoxy-N-(4-methoxyphenyl)thieno[2,3-b]quinoline-2-carboxamide
CID 1132039
N-(2,5-dimethoxyphenyl)-N-ethyl-7-methoxythieno[2,3-b]quinoline-2-carboxamide
CID 131841617
N-benzyl-N-ethyl-7-methoxythieno[2,3-b]quinoline-2-carboxamide
CID 15997237
4-(4-methoxyphenyl)-N-(2,4,6-trimethylphenyl)thiadiazole-5-carboxamide
CID 100746505
7-methylthieno[2,3-b]quinoline-2-carboxylate
CID 4126375

Frequently Asked Questions

What is the IUPAC name of 7-methoxy-N-(2,4,6-trimethylphenyl)thieno[2,3-b]quinoline-2-carboxamide?
The IUPAC name of 7-methoxy-N-(2,4,6-trimethylphenyl)thieno[2,3-b]quinoline-2-carboxamide (CID 2093613) is 7-methoxy-N-(2,4,6-trimethylphenyl)thieno[2,3-b]quinoline-2-carboxamide.
What is the SMILES notation for 7-methoxy-N-(2,4,6-trimethylphenyl)thieno[2,3-b]quinoline-2-carboxamide?
The canonical SMILES for 7-methoxy-N-(2,4,6-trimethylphenyl)thieno[2,3-b]quinoline-2-carboxamide is COc1ccc2cc3cc(C(=O)Nc4c(C)cc(C)cc4C)sc3nc2c1.
What is the InChIKey of 7-methoxy-N-(2,4,6-trimethylphenyl)thieno[2,3-b]quinoline-2-carboxamide?
The InChIKey is REIFWQVHLAIYSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H20N2O2S/c1-12-7-13(2)20(14(3)8-12)24-21(25)19-10-16-9-15-5-6-17(26-4)11-18(15)23-22(16)27-19/h5-11H,1-4H3,(H,24,25).
What are the key properties of 7-methoxy-N-(2,4,6-trimethylphenyl)thieno[2,3-b]quinoline-2-carboxamide?
7-methoxy-N-(2,4,6-trimethylphenyl)thieno[2,3-b]quinoline-2-carboxamide has a molecular weight of 376.48 g/mol, XLogP of 5.64, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methoxy-N-(2,4,6-trimethylphenyl)thieno[2,3-b]quinoline-2-carboxamide is sourced from PubChem (CID 2093613), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).