N-(2-methoxyphenyl)-1,3-dihydrothieno[3,4-b]quinolin-9-amine

C18H16N2OS — CID 110435268

IUPACN-(2-methoxyphenyl)-1,3-dihydrothieno[3,4-b]quinolin-9-amine
SMILESCOc1ccccc1Nc1c2c(nc3ccccc13)CSC2
InChIInChI=1S/C18H16N2OS/c1-21-17-9-5-4-8-15(17)20-18-12-6-2-3-7-14(12)19-16-11-22-10-13(16)18/h2-9H,10-11H2,1H3,(H,19,20)
InChIKeyGCGFWWTVYPZHRF-UHFFFAOYSA-N
MW308.41 g/mol
LogP4.73
Rot. Bonds3

About N-(2-methoxyphenyl)-1,3-dihydrothieno[3,4-b]quinolin-9-amine

N-(2-methoxyphenyl)-1,3-dihydrothieno[3,4-b]quinolin-9-amine (PubChem CID 110435268) has the molecular formula C18H16N2OS and a molecular weight of 308.41 g/mol. Its IUPAC name is N-(2-methoxyphenyl)-1,3-dihydrothieno[3,4-b]quinolin-9-amine.

Molecular Properties

Compound NameN-(2-methoxyphenyl)-1,3-dihydrothieno[3,4-b]quinolin-9-amine
PubChem CID110435268
Molecular FormulaC18H16N2OS
Molecular Weight308.41 g/mol
Exact Mass308.10
IUPAC NameN-(2-methoxyphenyl)-1,3-dihydrothieno[3,4-b]quinolin-9-amine
SMILESCOc1ccccc1Nc1c2c(nc3ccccc13)CSC2
InChIInChI=1S/C18H16N2OS/c1-21-17-9-5-4-8-15(17)20-18-12-6-2-3-7-14(12)19-16-11-22-10-13(16)18/h2-9H,10-11H2,1H3,(H,19,20)
InChIKeyGCGFWWTVYPZHRF-UHFFFAOYSA-N
XLogP4.73
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.41
LogP ≤ 54.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-propoxyphenyl)-1,3-dihydrothieno[3,4-b]quinolin-9-amine
CID 110435291
N-(2-methoxyphenyl)-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine
CID 720949
methyl 4-(1,3-dihydrothieno[3,4-b]quinolin-9-ylamino)benzoate
CID 110435280
N-(3-methylphenyl)-1,3-dihydrothieno[3,4-b]quinolin-9-amine
CID 110435258
N-(5-chloro-2-methoxyphenyl)-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine
CID 4060631
6-chloro-N-(2-methoxyphenyl)-1,2,3,4-tetrahydroacridin-9-amine
CID 20859019
N-(2-methoxyphenyl)-4-methylquinolin-2-amine
CID 847633
4-N-(2-methoxyphenyl)-2-N-methylquinazoline-2,4-diamine
CID 80769065
2-(2-methoxyanilino)quinoline-4-carbonitrile
CID 63885647
methyl 4-(2-methoxyanilino)quinoline-2-carboxylate
CID 53113238
N-(2-methoxyphenyl)-4-(4-methylpiperazin-1-yl)quinazolin-2-amine
CID 769569
N-[(2-methoxyphenyl)methyl]-1,2,3,4-tetrahydroacridin-9-amine
CID 122199173

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyphenyl)-1,3-dihydrothieno[3,4-b]quinolin-9-amine?
The IUPAC name of N-(2-methoxyphenyl)-1,3-dihydrothieno[3,4-b]quinolin-9-amine (CID 110435268) is N-(2-methoxyphenyl)-1,3-dihydrothieno[3,4-b]quinolin-9-amine.
What is the SMILES notation for N-(2-methoxyphenyl)-1,3-dihydrothieno[3,4-b]quinolin-9-amine?
The canonical SMILES for N-(2-methoxyphenyl)-1,3-dihydrothieno[3,4-b]quinolin-9-amine is COc1ccccc1Nc1c2c(nc3ccccc13)CSC2.
What is the InChIKey of N-(2-methoxyphenyl)-1,3-dihydrothieno[3,4-b]quinolin-9-amine?
The InChIKey is GCGFWWTVYPZHRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16N2OS/c1-21-17-9-5-4-8-15(17)20-18-12-6-2-3-7-14(12)19-16-11-22-10-13(16)18/h2-9H,10-11H2,1H3,(H,19,20).
What are the key properties of N-(2-methoxyphenyl)-1,3-dihydrothieno[3,4-b]quinolin-9-amine?
N-(2-methoxyphenyl)-1,3-dihydrothieno[3,4-b]quinolin-9-amine has a molecular weight of 308.41 g/mol, XLogP of 4.73, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyphenyl)-1,3-dihydrothieno[3,4-b]quinolin-9-amine is sourced from PubChem (CID 110435268), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).