9-N-(3-methoxyphenyl)thieno[2,3-f]quinoline-8,9-diamine

C18H15N3OS — CID 71154159

IUPAC9-N-(3-methoxyphenyl)thieno[2,3-f]quinoline-8,9-diamine
SMILESCOc1cccc(Nc2c(N)cnc3ccc4ccsc4c23)c1
InChIInChI=1S/C18H15N3OS/c1-22-13-4-2-3-12(9-13)21-17-14(19)10-20-15-6-5-11-7-8-23-18(11)16(15)17/h2-10H,19H2,1H3,(H,20,21)
InChIKeyNZNLOYSSWBSYCQ-UHFFFAOYSA-N
MW321.41 g/mol
LogP4.78
Rot. Bonds3

About 9-N-(3-methoxyphenyl)thieno[2,3-f]quinoline-8,9-diamine

9-N-(3-methoxyphenyl)thieno[2,3-f]quinoline-8,9-diamine (PubChem CID 71154159) has the molecular formula C18H15N3OS and a molecular weight of 321.41 g/mol. Its IUPAC name is 9-N-(3-methoxyphenyl)thieno[2,3-f]quinoline-8,9-diamine.

Molecular Properties

Compound Name9-N-(3-methoxyphenyl)thieno[2,3-f]quinoline-8,9-diamine
PubChem CID71154159
Molecular FormulaC18H15N3OS
Molecular Weight321.41 g/mol
Exact Mass321.09
IUPAC Name9-N-(3-methoxyphenyl)thieno[2,3-f]quinoline-8,9-diamine
SMILESCOc1cccc(Nc2c(N)cnc3ccc4ccsc4c23)c1
InChIInChI=1S/C18H15N3OS/c1-22-13-4-2-3-12(9-13)21-17-14(19)10-20-15-6-5-11-7-8-23-18(11)16(15)17/h2-10H,19H2,1H3,(H,20,21)
InChIKeyNZNLOYSSWBSYCQ-UHFFFAOYSA-N
XLogP4.78
TPSA60.17 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.41
LogP ≤ 54.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 9-N-(3-methoxyphenyl)thieno[2,3-f]quinoline-8,9-diamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

7-Methoxy-3-thiophen-3-yl-quinoline
CID 10331922
1-(7-Methoxy-2-(thiophen-3-yl)quinolin-3-yl)-n-(4-methoxybenzyl)methanamine
CID 52941357
7-[4-[4-(1-Benzothiophen-4-yl)piperazin-1-yl]butoxy]quinoline
CID 122172695
7-[3-[4-(1-Benzothiophen-4-yl)piperazin-1-yl]propoxy]quinoline
CID 122172696
n-Benzyl-1-(7-methoxy-2-(thiophen-3-yl)quinolin-3-yl)methanamine
CID 52945302
US10941138, Example 15
CID 135145270
US10941138, Example 2
CID 135145271
US10941138, Example 67
CID 135145283
US10941138, Example 57
CID 135145284
US10941138, Example 63
CID 135145310
US10941138, Example 9
CID 135145371
US10941138, Example 93
CID 135178793

Frequently Asked Questions

What is the IUPAC name of 9-N-(3-methoxyphenyl)thieno[2,3-f]quinoline-8,9-diamine?
The IUPAC name of 9-N-(3-methoxyphenyl)thieno[2,3-f]quinoline-8,9-diamine (CID 71154159) is 9-N-(3-methoxyphenyl)thieno[2,3-f]quinoline-8,9-diamine.
What is the SMILES notation for 9-N-(3-methoxyphenyl)thieno[2,3-f]quinoline-8,9-diamine?
The canonical SMILES for 9-N-(3-methoxyphenyl)thieno[2,3-f]quinoline-8,9-diamine is COc1cccc(Nc2c(N)cnc3ccc4ccsc4c23)c1.
What is the InChIKey of 9-N-(3-methoxyphenyl)thieno[2,3-f]quinoline-8,9-diamine?
The InChIKey is NZNLOYSSWBSYCQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15N3OS/c1-22-13-4-2-3-12(9-13)21-17-14(19)10-20-15-6-5-11-7-8-23-18(11)16(15)17/h2-10H,19H2,1H3,(H,20,21).
What are the key properties of 9-N-(3-methoxyphenyl)thieno[2,3-f]quinoline-8,9-diamine?
9-N-(3-methoxyphenyl)thieno[2,3-f]quinoline-8,9-diamine has a molecular weight of 321.41 g/mol, XLogP of 4.78, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 9-N-(3-methoxyphenyl)thieno[2,3-f]quinoline-8,9-diamine is sourced from PubChem (CID 71154159), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).