N-ethyl-2-methoxy-N-[[2-(methylaminomethyl)-1-benzothiophen-3-yl]methyl]ethanamine

C16H24N2OS — CID 62436475

IUPACN-ethyl-2-methoxy-N-[[2-(methylaminomethyl)-1-benzothiophen-3-yl]methyl]ethanamine
SMILESCCN(CCOC)Cc1c(CNC)sc2ccccc12
InChIInChI=1S/C16H24N2OS/c1-4-18(9-10-19-3)12-14-13-7-5-6-8-15(13)20-16(14)11-17-2/h5-8,17H,4,9-12H2,1-3H3
InChIKeySLTFLIANRHPTAX-UHFFFAOYSA-N
MW292.45 g/mol
LogP3.09
Rot. Bonds8

About N-ethyl-2-methoxy-N-[[2-(methylaminomethyl)-1-benzothiophen-3-yl]methyl]ethanamine

N-ethyl-2-methoxy-N-[[2-(methylaminomethyl)-1-benzothiophen-3-yl]methyl]ethanamine (PubChem CID 62436475) has the molecular formula C16H24N2OS and a molecular weight of 292.45 g/mol. Its IUPAC name is N-ethyl-2-methoxy-N-[[2-(methylaminomethyl)-1-benzothiophen-3-yl]methyl]ethanamine.

Molecular Properties

Compound NameN-ethyl-2-methoxy-N-[[2-(methylaminomethyl)-1-benzothiophen-3-yl]methyl]ethanamine
PubChem CID62436475
Molecular FormulaC16H24N2OS
Molecular Weight292.45 g/mol
Exact Mass292.16
IUPAC NameN-ethyl-2-methoxy-N-[[2-(methylaminomethyl)-1-benzothiophen-3-yl]methyl]ethanamine
SMILESCCN(CCOC)Cc1c(CNC)sc2ccccc12
InChIInChI=1S/C16H24N2OS/c1-4-18(9-10-19-3)12-14-13-7-5-6-8-15(13)20-16(14)11-17-2/h5-8,17H,4,9-12H2,1-3H3
InChIKeySLTFLIANRHPTAX-UHFFFAOYSA-N
XLogP3.09
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.45
LogP ≤ 53.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-ethyl-2-methoxy-N-[[2-(methylaminomethyl)-1-benzothiophen-3-yl]methyl]ethanamine with MolForge

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Related Compounds

1-[3-(methoxymethyl)-1-benzothiophen-2-yl]-N-methylmethanamine
CID 62445616
N-[[3-[[ethyl(propyl)amino]methyl]-1-benzothiophen-2-yl]methyl]propan-1-amine
CID 62422891
N-[[3-[[2-methoxyethyl(methyl)amino]methyl]-1-benzothiophen-2-yl]methyl]propan-1-amine
CID 62446892
N,N,N'-trimethyl-N'-[[2-(methylaminomethyl)-1-benzothiophen-3-yl]methyl]ethane-1,2-diamine
CID 63701253
N-[[2-(aminomethyl)-1-benzothiophen-3-yl]methyl]-N-ethylbutan-1-amine
CID 62424421
N-ethyl-2-methoxy-N-[[4-(methylaminomethyl)phenyl]methyl]ethanamine
CID 62434714
2-[[2-(aminomethyl)-1-benzothiophen-3-yl]methoxy]-N,N-diethylethanamine
CID 62459329
1-cyclopentyl-N-methyl-N-[[2-(methylaminomethyl)-1-benzothiophen-3-yl]methyl]methanamine
CID 63654913
N-[[2-(aminomethyl)-1-benzothiophen-3-yl]methyl]-N-ethyl-2-methylprop-2-en-1-amine
CID 62418991
N-[[3-(2-methoxyethoxymethyl)-1-benzothiophen-2-yl]methyl]propan-2-amine
CID 62456910
N-methyl-1-[3-(thiomorpholin-4-ylmethyl)-1-benzothiophen-2-yl]methanamine
CID 62418648
1-(3-tert-butyl-1-benzothiophen-2-yl)-N-methylmethanamine
CID 114378025

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-methoxy-N-[[2-(methylaminomethyl)-1-benzothiophen-3-yl]methyl]ethanamine?
The IUPAC name of N-ethyl-2-methoxy-N-[[2-(methylaminomethyl)-1-benzothiophen-3-yl]methyl]ethanamine (CID 62436475) is N-ethyl-2-methoxy-N-[[2-(methylaminomethyl)-1-benzothiophen-3-yl]methyl]ethanamine.
What is the SMILES notation for N-ethyl-2-methoxy-N-[[2-(methylaminomethyl)-1-benzothiophen-3-yl]methyl]ethanamine?
The canonical SMILES for N-ethyl-2-methoxy-N-[[2-(methylaminomethyl)-1-benzothiophen-3-yl]methyl]ethanamine is CCN(CCOC)Cc1c(CNC)sc2ccccc12.
What is the InChIKey of N-ethyl-2-methoxy-N-[[2-(methylaminomethyl)-1-benzothiophen-3-yl]methyl]ethanamine?
The InChIKey is SLTFLIANRHPTAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2OS/c1-4-18(9-10-19-3)12-14-13-7-5-6-8-15(13)20-16(14)11-17-2/h5-8,17H,4,9-12H2,1-3H3.
What are the key properties of N-ethyl-2-methoxy-N-[[2-(methylaminomethyl)-1-benzothiophen-3-yl]methyl]ethanamine?
N-ethyl-2-methoxy-N-[[2-(methylaminomethyl)-1-benzothiophen-3-yl]methyl]ethanamine has a molecular weight of 292.45 g/mol, XLogP of 3.09, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-methoxy-N-[[2-(methylaminomethyl)-1-benzothiophen-3-yl]methyl]ethanamine is sourced from PubChem (CID 62436475), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).