8-methyl-4-oxo-N,N-dipropyl-5H-thieno[3,2-c]quinoline-2-carboxamide

C19H22N2O2S — CID 6620052

IUPAC8-methyl-4-oxo-N,N-dipropyl-5H-thieno[3,2-c]quinoline-2-carboxamide
SMILESCCCN(CCC)C(=O)c1cc2c(=O)[nH]c3ccc(C)cc3c2s1
InChIInChI=1S/C19H22N2O2S/c1-4-8-21(9-5-2)19(23)16-11-14-17(24-16)13-10-12(3)6-7-15(13)20-18(14)22/h6-7,10-11H,4-5,8-9H2,1-3H3,(H,20,22)
InChIKeyUFXXFNHNCYDIKX-UHFFFAOYSA-N
MW342.46 g/mol
LogP4.31
Rot. Bonds5

About 8-methyl-4-oxo-N,N-dipropyl-5H-thieno[3,2-c]quinoline-2-carboxamide

8-methyl-4-oxo-N,N-dipropyl-5H-thieno[3,2-c]quinoline-2-carboxamide (PubChem CID 6620052) has the molecular formula C19H22N2O2S and a molecular weight of 342.46 g/mol. Its IUPAC name is 8-methyl-4-oxo-N,N-dipropyl-5H-thieno[3,2-c]quinoline-2-carboxamide.

Molecular Properties

Compound Name8-methyl-4-oxo-N,N-dipropyl-5H-thieno[3,2-c]quinoline-2-carboxamide
PubChem CID6620052
Molecular FormulaC19H22N2O2S
Molecular Weight342.46 g/mol
Exact Mass342.14
IUPAC Name8-methyl-4-oxo-N,N-dipropyl-5H-thieno[3,2-c]quinoline-2-carboxamide
SMILESCCCN(CCC)C(=O)c1cc2c(=O)[nH]c3ccc(C)cc3c2s1
InChIInChI=1S/C19H22N2O2S/c1-4-8-21(9-5-2)19(23)16-11-14-17(24-16)13-10-12(3)6-7-15(13)20-18(14)22/h6-7,10-11H,4-5,8-9H2,1-3H3,(H,20,22)
InChIKeyUFXXFNHNCYDIKX-UHFFFAOYSA-N
XLogP4.31
TPSA53.17 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.46
LogP ≤ 54.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 8-methyl-4-oxo-N,N-dipropyl-5H-thieno[3,2-c]quinoline-2-carboxamide?
The IUPAC name of 8-methyl-4-oxo-N,N-dipropyl-5H-thieno[3,2-c]quinoline-2-carboxamide (CID 6620052) is 8-methyl-4-oxo-N,N-dipropyl-5H-thieno[3,2-c]quinoline-2-carboxamide.
What is the SMILES notation for 8-methyl-4-oxo-N,N-dipropyl-5H-thieno[3,2-c]quinoline-2-carboxamide?
The canonical SMILES for 8-methyl-4-oxo-N,N-dipropyl-5H-thieno[3,2-c]quinoline-2-carboxamide is CCCN(CCC)C(=O)c1cc2c(=O)[nH]c3ccc(C)cc3c2s1.
What is the InChIKey of 8-methyl-4-oxo-N,N-dipropyl-5H-thieno[3,2-c]quinoline-2-carboxamide?
The InChIKey is UFXXFNHNCYDIKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2O2S/c1-4-8-21(9-5-2)19(23)16-11-14-17(24-16)13-10-12(3)6-7-15(13)20-18(14)22/h6-7,10-11H,4-5,8-9H2,1-3H3,(H,20,22).
What are the key properties of 8-methyl-4-oxo-N,N-dipropyl-5H-thieno[3,2-c]quinoline-2-carboxamide?
8-methyl-4-oxo-N,N-dipropyl-5H-thieno[3,2-c]quinoline-2-carboxamide has a molecular weight of 342.46 g/mol, XLogP of 4.31, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8-methyl-4-oxo-N,N-dipropyl-5H-thieno[3,2-c]quinoline-2-carboxamide is sourced from PubChem (CID 6620052), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).