(6S,8S)-9-amino-6-(4-methoxyphenyl)-5,6,7,8-tetrahydrothieno[3,2-b]quinolin-8-ol

C18H18N2O2S — CID 44613866

IUPAC(6S,8S)-9-amino-6-(4-methoxyphenyl)-5,6,7,8-tetrahydrothieno[3,2-b]quinolin-8-ol
SMILESCOc1ccc([C@H]2Cc3nc4ccsc4c(N)c3[C@@H](O)C2)cc1
InChIInChI=1S/C18H18N2O2S/c1-22-12-4-2-10(3-5-12)11-8-14-16(15(21)9-11)17(19)18-13(20-14)6-7-23-18/h2-7,11,15,21H,8-9H2,1H3,(H2,19,20)/t11-,15-/m0/s1
InChIKeyMONBJLOOKWFGRG-NHYWBVRUSA-N
MW326.42 g/mol
LogP3.65
Rot. Bonds2

About (6S,8S)-9-amino-6-(4-methoxyphenyl)-5,6,7,8-tetrahydrothieno[3,2-b]quinolin-8-ol

(6S,8S)-9-amino-6-(4-methoxyphenyl)-5,6,7,8-tetrahydrothieno[3,2-b]quinolin-8-ol (PubChem CID 44613866) has the molecular formula C18H18N2O2S and a molecular weight of 326.42 g/mol. Its IUPAC name is (6S,8S)-9-amino-6-(4-methoxyphenyl)-5,6,7,8-tetrahydrothieno[3,2-b]quinolin-8-ol.

Molecular Properties

Compound Name(6S,8S)-9-amino-6-(4-methoxyphenyl)-5,6,7,8-tetrahydrothieno[3,2-b]quinolin-8-ol
PubChem CID44613866
Molecular FormulaC18H18N2O2S
Molecular Weight326.42 g/mol
Exact Mass326.11
IUPAC Name(6S,8S)-9-amino-6-(4-methoxyphenyl)-5,6,7,8-tetrahydrothieno[3,2-b]quinolin-8-ol
SMILESCOc1ccc([C@H]2Cc3nc4ccsc4c(N)c3[C@@H](O)C2)cc1
InChIInChI=1S/C18H18N2O2S/c1-22-12-4-2-10(3-5-12)11-8-14-16(15(21)9-11)17(19)18-13(20-14)6-7-23-18/h2-7,11,15,21H,8-9H2,1H3,(H2,19,20)/t11-,15-/m0/s1
InChIKeyMONBJLOOKWFGRG-NHYWBVRUSA-N
XLogP3.65
TPSA68.37 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.42
LogP ≤ 53.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze (6S,8S)-9-amino-6-(4-methoxyphenyl)-5,6,7,8-tetrahydrothieno[3,2-b]quinolin-8-ol with MolForge

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Related Compounds

9-amino-6-(4-methylphenyl)-6,7-dihydro-5H-thieno[3,2-b]quinolin-8-one
CID 44614084
(5S,7S)-4-amino-7-methyl-5,6,7,8-tetrahydrothieno[2,3-b]quinolin-5-ol
CID 23659246
9-amino-7-chloro-3-(4-methoxyphenyl)-3,4-dihydro-2H-acridin-1-one
CID 167530820
3-(4-methoxyphenyl)-N-(1,3-thiazol-2-ylmethyl)cyclobutan-1-amine
CID 61285030
2-[[2-(4-methoxyphenyl)azepan-1-yl]methyl]-3H-thieno[3,2-d]pyrimidin-4-one
CID 135670638
3-(4-methoxyphenyl)-1-methylazetidine
CID 134399978
1-methoxy-4-(3-phenylcyclobutyl)benzene
CID 125465439
5-(4-methoxyphenyl)piperidin-3-ol
CID 142686549
ethyl 3-benzylsulfanyl-4-hydroxy-6-(4-methoxyphenyl)-4,5,6,7-tetrahydro-2-benzothiophene-1-carboxylate
CID 146160814
1-(4,4-dimethylcyclohexyl)-4-methoxybenzene
CID 18414650
(3R,5R)-5-(4-methoxyphenyl)-1-methylpiperidin-3-amine
CID 170701447
(3-chlorothiophen-2-yl)-(4-methoxyphenyl)methanamine
CID 80529927

Frequently Asked Questions

What is the IUPAC name of (6S,8S)-9-amino-6-(4-methoxyphenyl)-5,6,7,8-tetrahydrothieno[3,2-b]quinolin-8-ol?
The IUPAC name of (6S,8S)-9-amino-6-(4-methoxyphenyl)-5,6,7,8-tetrahydrothieno[3,2-b]quinolin-8-ol (CID 44613866) is (6S,8S)-9-amino-6-(4-methoxyphenyl)-5,6,7,8-tetrahydrothieno[3,2-b]quinolin-8-ol.
What is the SMILES notation for (6S,8S)-9-amino-6-(4-methoxyphenyl)-5,6,7,8-tetrahydrothieno[3,2-b]quinolin-8-ol?
The canonical SMILES for (6S,8S)-9-amino-6-(4-methoxyphenyl)-5,6,7,8-tetrahydrothieno[3,2-b]quinolin-8-ol is COc1ccc([C@H]2Cc3nc4ccsc4c(N)c3[C@@H](O)C2)cc1.
What is the InChIKey of (6S,8S)-9-amino-6-(4-methoxyphenyl)-5,6,7,8-tetrahydrothieno[3,2-b]quinolin-8-ol?
The InChIKey is MONBJLOOKWFGRG-NHYWBVRUSA-N. The full InChI is InChI=1S/C18H18N2O2S/c1-22-12-4-2-10(3-5-12)11-8-14-16(15(21)9-11)17(19)18-13(20-14)6-7-23-18/h2-7,11,15,21H,8-9H2,1H3,(H2,19,20)/t11-,15-/m0/s1.
What are the key properties of (6S,8S)-9-amino-6-(4-methoxyphenyl)-5,6,7,8-tetrahydrothieno[3,2-b]quinolin-8-ol?
(6S,8S)-9-amino-6-(4-methoxyphenyl)-5,6,7,8-tetrahydrothieno[3,2-b]quinolin-8-ol has a molecular weight of 326.42 g/mol, XLogP of 3.65, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (6S,8S)-9-amino-6-(4-methoxyphenyl)-5,6,7,8-tetrahydrothieno[3,2-b]quinolin-8-ol is sourced from PubChem (CID 44613866), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).