6-methoxy-N-(5-methyl-1,2-oxazol-3-yl)thieno[2,3-b]quinoline-2-carboxamide

C17H13N3O3S — CID 5189392

IUPAC6-methoxy-N-(5-methyl-1,2-oxazol-3-yl)thieno[2,3-b]quinoline-2-carboxamide
SMILESCOc1ccc2nc3sc(C(=O)Nc4cc(C)on4)cc3cc2c1
InChIInChI=1S/C17H13N3O3S/c1-9-5-15(20-23-9)19-16(21)14-8-11-6-10-7-12(22-2)3-4-13(10)18-17(11)24-14/h3-8H,1-2H3,(H,19,20,21)
InChIKeyBPQIENUZNFJPLP-UHFFFAOYSA-N
MW339.38 g/mol
LogP4.01
Rot. Bonds3

About 6-methoxy-N-(5-methyl-1,2-oxazol-3-yl)thieno[2,3-b]quinoline-2-carboxamide

6-methoxy-N-(5-methyl-1,2-oxazol-3-yl)thieno[2,3-b]quinoline-2-carboxamide (PubChem CID 5189392) has the molecular formula C17H13N3O3S and a molecular weight of 339.38 g/mol. Its IUPAC name is 6-methoxy-N-(5-methyl-1,2-oxazol-3-yl)thieno[2,3-b]quinoline-2-carboxamide.

Molecular Properties

Compound Name6-methoxy-N-(5-methyl-1,2-oxazol-3-yl)thieno[2,3-b]quinoline-2-carboxamide
PubChem CID5189392
Molecular FormulaC17H13N3O3S
Molecular Weight339.38 g/mol
Exact Mass339.07
IUPAC Name6-methoxy-N-(5-methyl-1,2-oxazol-3-yl)thieno[2,3-b]quinoline-2-carboxamide
SMILESCOc1ccc2nc3sc(C(=O)Nc4cc(C)on4)cc3cc2c1
InChIInChI=1S/C17H13N3O3S/c1-9-5-15(20-23-9)19-16(21)14-8-11-6-10-7-12(22-2)3-4-13(10)18-17(11)24-14/h3-8H,1-2H3,(H,19,20,21)
InChIKeyBPQIENUZNFJPLP-UHFFFAOYSA-N
XLogP4.01
TPSA77.25 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.38
LogP ≤ 54.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

6-methoxy-N-[(5-methylfuran-2-yl)methyl]thieno[2,3-b]quinoline-2-carboxamide
CID 15995302
N-(3,5-dimethoxyphenyl)-6-methylthieno[2,3-b]quinoline-2-carboxamide
CID 20966485
7-methoxy-N-(2,4,6-trimethylphenyl)thieno[2,3-b]quinoline-2-carboxamide
CID 2093613
N-[(1R,2S,3S)-2,3-dimethylcyclohexyl]-6-methoxythieno[2,3-b]quinoline-2-carboxamide
CID 92656948
N-(2,5-dimethoxyphenyl)-7-methylthieno[2,3-b]quinoline-2-carboxamide
CID 15990436
N-[(5-bromo-2-methoxyphenyl)methyl]-6-methoxythieno[2,3-b]quinoline-2-carboxamide
CID 15999971
2,4-dimethoxy-N-(5-methyl-1,2-oxazol-3-yl)benzamide
CID 670331
(6-methoxythieno[2,3-b]quinolin-2-yl)-(4-methylpiperazin-4-ium-1-yl)methanone
CID 3298499
6-methoxy-N-(5-methyl-1,2-oxazol-3-yl)-1H-indole-2-carboxamide
CID 47155094
1-N-(3-methoxyphenyl)-3-N-(5-methyl-1,2-oxazol-3-yl)benzene-1,3-dicarboxamide
CID 109057638
N-(2-chloro-4-methylphenyl)-6-methylthieno[2,3-b]quinoline-2-carboxamide
CID 20966408
4-[(4-methoxyphenyl)sulfamoyl]-N-(5-methyl-1,2-oxazol-3-yl)thiophene-2-carboxamide
CID 6504134

Frequently Asked Questions

What is the IUPAC name of 6-methoxy-N-(5-methyl-1,2-oxazol-3-yl)thieno[2,3-b]quinoline-2-carboxamide?
The IUPAC name of 6-methoxy-N-(5-methyl-1,2-oxazol-3-yl)thieno[2,3-b]quinoline-2-carboxamide (CID 5189392) is 6-methoxy-N-(5-methyl-1,2-oxazol-3-yl)thieno[2,3-b]quinoline-2-carboxamide.
What is the SMILES notation for 6-methoxy-N-(5-methyl-1,2-oxazol-3-yl)thieno[2,3-b]quinoline-2-carboxamide?
The canonical SMILES for 6-methoxy-N-(5-methyl-1,2-oxazol-3-yl)thieno[2,3-b]quinoline-2-carboxamide is COc1ccc2nc3sc(C(=O)Nc4cc(C)on4)cc3cc2c1.
What is the InChIKey of 6-methoxy-N-(5-methyl-1,2-oxazol-3-yl)thieno[2,3-b]quinoline-2-carboxamide?
The InChIKey is BPQIENUZNFJPLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H13N3O3S/c1-9-5-15(20-23-9)19-16(21)14-8-11-6-10-7-12(22-2)3-4-13(10)18-17(11)24-14/h3-8H,1-2H3,(H,19,20,21).
What are the key properties of 6-methoxy-N-(5-methyl-1,2-oxazol-3-yl)thieno[2,3-b]quinoline-2-carboxamide?
6-methoxy-N-(5-methyl-1,2-oxazol-3-yl)thieno[2,3-b]quinoline-2-carboxamide has a molecular weight of 339.38 g/mol, XLogP of 4.01, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-N-(5-methyl-1,2-oxazol-3-yl)thieno[2,3-b]quinoline-2-carboxamide is sourced from PubChem (CID 5189392), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).