2-(5-ethylthiophen-2-yl)-N-methyl-1-quinolin-6-ylethanamine

C18H20N2S — CID 63097564

IUPAC2-(5-ethylthiophen-2-yl)-N-methyl-1-quinolin-6-ylethanamine
SMILESCCc1ccc(CC(NC)c2ccc3ncccc3c2)s1
InChIInChI=1S/C18H20N2S/c1-3-15-7-8-16(21-15)12-18(19-2)14-6-9-17-13(11-14)5-4-10-20-17/h4-11,18-19H,3,12H2,1-2H3
InChIKeyHSHATFPLXXECTA-UHFFFAOYSA-N
MW296.44 g/mol
LogP4.36
Rot. Bonds5

About 2-(5-ethylthiophen-2-yl)-N-methyl-1-quinolin-6-ylethanamine

2-(5-ethylthiophen-2-yl)-N-methyl-1-quinolin-6-ylethanamine (PubChem CID 63097564) has the molecular formula C18H20N2S and a molecular weight of 296.44 g/mol. Its IUPAC name is 2-(5-ethylthiophen-2-yl)-N-methyl-1-quinolin-6-ylethanamine.

Molecular Properties

Compound Name2-(5-ethylthiophen-2-yl)-N-methyl-1-quinolin-6-ylethanamine
PubChem CID63097564
Molecular FormulaC18H20N2S
Molecular Weight296.44 g/mol
Exact Mass296.13
IUPAC Name2-(5-ethylthiophen-2-yl)-N-methyl-1-quinolin-6-ylethanamine
SMILESCCc1ccc(CC(NC)c2ccc3ncccc3c2)s1
InChIInChI=1S/C18H20N2S/c1-3-15-7-8-16(21-15)12-18(19-2)14-6-9-17-13(11-14)5-4-10-20-17/h4-11,18-19H,3,12H2,1-2H3
InChIKeyHSHATFPLXXECTA-UHFFFAOYSA-N
XLogP4.36
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.44
LogP ≤ 54.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-1-quinolin-6-ylpropan-1-amine
CID 63095975
2-(5-bromothiophen-2-yl)-N-ethyl-1-quinolin-6-ylethanamine
CID 63097218
2-(2-chlorophenyl)-N-methyl-1-quinolin-6-ylethanamine
CID 63095103
N-methyl-1-quinolin-6-yl-4-thiophen-2-ylbutan-1-amine
CID 105172395
2-(5-ethylthiophen-2-yl)-N-methyl-1-(3-propoxyphenyl)ethanamine
CID 115842505
3-(furan-2-yl)-N-methyl-1-quinolin-6-ylpropan-1-amine
CID 105172364
1-(3-chloro-4-iodophenyl)-2-(5-ethylthiophen-2-yl)-N-methylethanamine
CID 103214976
2-(5-ethylthiophen-2-yl)-N-methyl-1-(5-methylfuran-3-yl)ethanamine
CID 115842340
1-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-N-methyl-1-quinolin-6-ylmethanamine
CID 63970196
3-cyclopentyl-N-methyl-1-quinolin-6-ylpropan-1-amine
CID 105021015
2-(3-ethoxycyclobutyl)-N-methyl-1-quinolin-6-ylethanamine
CID 103169272
2-(5-ethylthiophen-2-yl)-1-(3-fluoro-4-methoxyphenyl)-N-methylethanamine
CID 115842301

Frequently Asked Questions

What is the IUPAC name of 2-(5-ethylthiophen-2-yl)-N-methyl-1-quinolin-6-ylethanamine?
The IUPAC name of 2-(5-ethylthiophen-2-yl)-N-methyl-1-quinolin-6-ylethanamine (CID 63097564) is 2-(5-ethylthiophen-2-yl)-N-methyl-1-quinolin-6-ylethanamine.
What is the SMILES notation for 2-(5-ethylthiophen-2-yl)-N-methyl-1-quinolin-6-ylethanamine?
The canonical SMILES for 2-(5-ethylthiophen-2-yl)-N-methyl-1-quinolin-6-ylethanamine is CCc1ccc(CC(NC)c2ccc3ncccc3c2)s1.
What is the InChIKey of 2-(5-ethylthiophen-2-yl)-N-methyl-1-quinolin-6-ylethanamine?
The InChIKey is HSHATFPLXXECTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N2S/c1-3-15-7-8-16(21-15)12-18(19-2)14-6-9-17-13(11-14)5-4-10-20-17/h4-11,18-19H,3,12H2,1-2H3.
What are the key properties of 2-(5-ethylthiophen-2-yl)-N-methyl-1-quinolin-6-ylethanamine?
2-(5-ethylthiophen-2-yl)-N-methyl-1-quinolin-6-ylethanamine has a molecular weight of 296.44 g/mol, XLogP of 4.36, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-ethylthiophen-2-yl)-N-methyl-1-quinolin-6-ylethanamine is sourced from PubChem (CID 63097564), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).