9-amino-6-(4-methylphenyl)-6,7-dihydro-5H-thieno[3,2-b]quinolin-8-one

C18H16N2OS — CID 44614084

IUPAC9-amino-6-(4-methylphenyl)-6,7-dihydro-5H-thieno[3,2-b]quinolin-8-one
SMILESCc1ccc(C2CC(=O)c3c(nc4ccsc4c3N)C2)cc1
InChIInChI=1S/C18H16N2OS/c1-10-2-4-11(5-3-10)12-8-14-16(15(21)9-12)17(19)18-13(20-14)6-7-22-18/h2-7,12H,8-9H2,1H3,(H2,19,20)
InChIKeyOWUDWIYVYUMWJL-UHFFFAOYSA-N
MW308.41 g/mol
LogP4.10
Rot. Bonds1

About 9-amino-6-(4-methylphenyl)-6,7-dihydro-5H-thieno[3,2-b]quinolin-8-one

9-amino-6-(4-methylphenyl)-6,7-dihydro-5H-thieno[3,2-b]quinolin-8-one (PubChem CID 44614084) has the molecular formula C18H16N2OS and a molecular weight of 308.41 g/mol. Its IUPAC name is 9-amino-6-(4-methylphenyl)-6,7-dihydro-5H-thieno[3,2-b]quinolin-8-one.

Molecular Properties

Compound Name9-amino-6-(4-methylphenyl)-6,7-dihydro-5H-thieno[3,2-b]quinolin-8-one
PubChem CID44614084
Molecular FormulaC18H16N2OS
Molecular Weight308.41 g/mol
Exact Mass308.10
IUPAC Name9-amino-6-(4-methylphenyl)-6,7-dihydro-5H-thieno[3,2-b]quinolin-8-one
SMILESCc1ccc(C2CC(=O)c3c(nc4ccsc4c3N)C2)cc1
InChIInChI=1S/C18H16N2OS/c1-10-2-4-11(5-3-10)12-8-14-16(15(21)9-12)17(19)18-13(20-14)6-7-22-18/h2-7,12H,8-9H2,1H3,(H2,19,20)
InChIKeyOWUDWIYVYUMWJL-UHFFFAOYSA-N
XLogP4.10
TPSA55.98 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.41
LogP ≤ 54.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 9-amino-6-(4-methylphenyl)-6,7-dihydro-5H-thieno[3,2-b]quinolin-8-one with MolForge

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Related Compounds

(6S,8S)-9-amino-6-(4-methoxyphenyl)-5,6,7,8-tetrahydrothieno[3,2-b]quinolin-8-ol
CID 44613866
2-amino-7-(4-chlorophenyl)-4-methyl-7,8-dihydro-6H-quinazolin-5-one
CID 11948703
9-amino-7-chloro-3-(4-methoxyphenyl)-3,4-dihydro-2H-acridin-1-one
CID 167530820
(7R)-2-anilino-4-methyl-7-(4-methylphenyl)-7,8-dihydro-6H-quinazolin-5-one
CID 41386580
(7R)-2-(4-fluoroanilino)-4-methyl-7-(4-methylphenyl)-7,8-dihydro-6H-quinazolin-5-one
CID 41386690
(NE)-N-[2-amino-4-methyl-7-(4-methylphenyl)-7,8-dihydro-6H-quinazolin-5-ylidene]hydroxylamine
CID 25167617
(6S)-2,6-bis(4-methylphenyl)-6,7-dihydro-5H-[1,2,4]triazolo[5,1-b]quinazolin-8-one
CID 29100674
(7S)-2-(4-fluoroanilino)-7-(4-fluorophenyl)-4-methyl-7,8-dihydro-6H-quinazolin-5-one
CID 41386692
2-(4-methoxyanilino)-7-(4-methoxyphenyl)-4-methyl-7,8-dihydro-6H-quinazolin-5-one
CID 16583996
7-(4-fluorophenyl)-4-methyl-2-[(4-methylquinazolin-2-yl)amino]-7,8-dihydro-6H-quinazolin-5-one
CID 17228743
(6S)-6-(4-methylphenyl)-2-methylsulfanyl-6,7-dihydro-5H-[1,2,4]triazolo[5,1-b]quinazolin-8-one
CID 25421022
2-[(4,6-dimethylquinazolin-2-yl)amino]-4-methyl-7-thiophen-2-yl-7,8-dihydro-6H-quinazolin-5-one
CID 66508167

Frequently Asked Questions

What is the IUPAC name of 9-amino-6-(4-methylphenyl)-6,7-dihydro-5H-thieno[3,2-b]quinolin-8-one?
The IUPAC name of 9-amino-6-(4-methylphenyl)-6,7-dihydro-5H-thieno[3,2-b]quinolin-8-one (CID 44614084) is 9-amino-6-(4-methylphenyl)-6,7-dihydro-5H-thieno[3,2-b]quinolin-8-one.
What is the SMILES notation for 9-amino-6-(4-methylphenyl)-6,7-dihydro-5H-thieno[3,2-b]quinolin-8-one?
The canonical SMILES for 9-amino-6-(4-methylphenyl)-6,7-dihydro-5H-thieno[3,2-b]quinolin-8-one is Cc1ccc(C2CC(=O)c3c(nc4ccsc4c3N)C2)cc1.
What is the InChIKey of 9-amino-6-(4-methylphenyl)-6,7-dihydro-5H-thieno[3,2-b]quinolin-8-one?
The InChIKey is OWUDWIYVYUMWJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16N2OS/c1-10-2-4-11(5-3-10)12-8-14-16(15(21)9-12)17(19)18-13(20-14)6-7-22-18/h2-7,12H,8-9H2,1H3,(H2,19,20).
What are the key properties of 9-amino-6-(4-methylphenyl)-6,7-dihydro-5H-thieno[3,2-b]quinolin-8-one?
9-amino-6-(4-methylphenyl)-6,7-dihydro-5H-thieno[3,2-b]quinolin-8-one has a molecular weight of 308.41 g/mol, XLogP of 4.10, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 9-amino-6-(4-methylphenyl)-6,7-dihydro-5H-thieno[3,2-b]quinolin-8-one is sourced from PubChem (CID 44614084), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).