2-(3,4-dihydro-2H-quinolin-1-yl)-2-thiophen-3-ylethanamine

C15H18N2S — CID 16792564

IUPAC2-(3,4-dihydro-2H-quinolin-1-yl)-2-thiophen-3-ylethanamine
SMILESNCC(c1ccsc1)N1CCCc2ccccc21
InChIInChI=1S/C15H18N2S/c16-10-15(13-7-9-18-11-13)17-8-3-5-12-4-1-2-6-14(12)17/h1-2,4,6-7,9,11,15H,3,5,8,10,16H2
InChIKeyAZDIXXVFEIPWPR-UHFFFAOYSA-N
MW258.39 g/mol
LogP3.20
Rot. Bonds3

About 2-(3,4-dihydro-2H-quinolin-1-yl)-2-thiophen-3-ylethanamine

2-(3,4-dihydro-2H-quinolin-1-yl)-2-thiophen-3-ylethanamine (PubChem CID 16792564) has the molecular formula C15H18N2S and a molecular weight of 258.39 g/mol. Its IUPAC name is 2-(3,4-dihydro-2H-quinolin-1-yl)-2-thiophen-3-ylethanamine.

Molecular Properties

Compound Name2-(3,4-dihydro-2H-quinolin-1-yl)-2-thiophen-3-ylethanamine
PubChem CID16792564
Molecular FormulaC15H18N2S
Molecular Weight258.39 g/mol
Exact Mass258.12
IUPAC Name2-(3,4-dihydro-2H-quinolin-1-yl)-2-thiophen-3-ylethanamine
SMILESNCC(c1ccsc1)N1CCCc2ccccc21
InChIInChI=1S/C15H18N2S/c16-10-15(13-7-9-18-11-13)17-8-3-5-12-4-1-2-6-14(12)17/h1-2,4,6-7,9,11,15H,3,5,8,10,16H2
InChIKeyAZDIXXVFEIPWPR-UHFFFAOYSA-N
XLogP3.20
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.39
LogP ≤ 53.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)-2-thiophen-3-ylethanamine
CID 63404092
2-(3-bromophenyl)-2-(3,4-dihydro-2H-quinolin-1-yl)ethanamine
CID 43180447
3-(2,3-dihydroindol-1-yl)-N-methyl-3-thiophen-3-ylpropan-1-amine
CID 137442813
2-(3-chloro-4-methylphenyl)-2-(3,4-dihydro-2H-quinolin-1-yl)ethanamine
CID 106817234
2-(5-chlorothiophen-2-yl)-2-(3,4-dihydro-2H-quinolin-1-yl)ethanamine
CID 43146883
2-[4-(2-chlorophenyl)piperazin-1-yl]-2-thiophen-3-ylethanamine
CID 43118100
2-(3,4-dihydro-2H-quinolin-1-yl)-2-phenylethanol
CID 155093221
4-(3,4-dihydro-2H-quinolin-1-yl)pentan-1-amine
CID 62425766
2-(2,3-dihydroindol-1-yl)-2-(3-methylphenyl)ethanamine
CID 16793061
2-(1,3-benzodioxol-5-yl)-2-(2,3-dihydroindol-1-yl)ethanamine
CID 43327440
2-(2,3-dihydroindol-1-yl)-2-(furan-2-yl)ethanamine
CID 16791029
4-[1-(2,3,4,5-tetrahydro-1-benzazepin-1-yl)propyl]phenol
CID 82966412

Frequently Asked Questions

What is the IUPAC name of 2-(3,4-dihydro-2H-quinolin-1-yl)-2-thiophen-3-ylethanamine?
The IUPAC name of 2-(3,4-dihydro-2H-quinolin-1-yl)-2-thiophen-3-ylethanamine (CID 16792564) is 2-(3,4-dihydro-2H-quinolin-1-yl)-2-thiophen-3-ylethanamine.
What is the SMILES notation for 2-(3,4-dihydro-2H-quinolin-1-yl)-2-thiophen-3-ylethanamine?
The canonical SMILES for 2-(3,4-dihydro-2H-quinolin-1-yl)-2-thiophen-3-ylethanamine is NCC(c1ccsc1)N1CCCc2ccccc21.
What is the InChIKey of 2-(3,4-dihydro-2H-quinolin-1-yl)-2-thiophen-3-ylethanamine?
The InChIKey is AZDIXXVFEIPWPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2S/c16-10-15(13-7-9-18-11-13)17-8-3-5-12-4-1-2-6-14(12)17/h1-2,4,6-7,9,11,15H,3,5,8,10,16H2.
What are the key properties of 2-(3,4-dihydro-2H-quinolin-1-yl)-2-thiophen-3-ylethanamine?
2-(3,4-dihydro-2H-quinolin-1-yl)-2-thiophen-3-ylethanamine has a molecular weight of 258.39 g/mol, XLogP of 3.20, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,4-dihydro-2H-quinolin-1-yl)-2-thiophen-3-ylethanamine is sourced from PubChem (CID 16792564), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).