2-(3-methoxyphenyl)-1-(3-methoxythiophen-2-yl)-N-methylethanamine

C15H19NO2S — CID 81121763

IUPAC2-(3-methoxyphenyl)-1-(3-methoxythiophen-2-yl)-N-methylethanamine
SMILESCNC(Cc1cccc(OC)c1)c1sccc1OC
InChIInChI=1S/C15H19NO2S/c1-16-13(15-14(18-3)7-8-19-15)10-11-5-4-6-12(9-11)17-2/h4-9,13,16H,10H2,1-3H3
InChIKeyXLDSXNIKIVWHGS-UHFFFAOYSA-N
MW277.39 g/mol
LogP3.27
Rot. Bonds6

About 2-(3-methoxyphenyl)-1-(3-methoxythiophen-2-yl)-N-methylethanamine

2-(3-methoxyphenyl)-1-(3-methoxythiophen-2-yl)-N-methylethanamine (PubChem CID 81121763) has the molecular formula C15H19NO2S and a molecular weight of 277.39 g/mol. Its IUPAC name is 2-(3-methoxyphenyl)-1-(3-methoxythiophen-2-yl)-N-methylethanamine.

Molecular Properties

Compound Name2-(3-methoxyphenyl)-1-(3-methoxythiophen-2-yl)-N-methylethanamine
PubChem CID81121763
Molecular FormulaC15H19NO2S
Molecular Weight277.39 g/mol
Exact Mass277.11
IUPAC Name2-(3-methoxyphenyl)-1-(3-methoxythiophen-2-yl)-N-methylethanamine
SMILESCNC(Cc1cccc(OC)c1)c1sccc1OC
InChIInChI=1S/C15H19NO2S/c1-16-13(15-14(18-3)7-8-19-15)10-11-5-4-6-12(9-11)17-2/h4-9,13,16H,10H2,1-3H3
InChIKeyXLDSXNIKIVWHGS-UHFFFAOYSA-N
XLogP3.27
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.39
LogP ≤ 53.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(3-chlorothiophen-2-yl)-2-(3-methoxyphenyl)-N-methylethanamine
CID 80529156
2-(2-fluoro-3-methoxyphenyl)-1-(3-methoxythiophen-2-yl)-N-methylethanamine
CID 105035509
2-(3-chlorophenyl)-N-ethyl-1-(3-methoxythiophen-2-yl)ethanamine
CID 81122564
1-(2,6-difluorophenyl)-2-(3-methoxyphenyl)-N-methylethanamine
CID 61063803
2-(3-methoxyphenyl)-N-methyl-1-(4-propan-2-ylphenyl)ethanamine
CID 43625329
2-(2-chlorophenyl)-1-(3-methoxythiophen-2-yl)-N-methylethanamine
CID 81122254
2-(3-methoxyphenyl)-1-(3-methylthiophen-2-yl)ethanol
CID 55006586
3-chloro-2-[1-chloro-2-(3-methoxyphenyl)ethyl]thiophene
CID 80530538
2-(2-ethyl-5-methylpyrazol-3-yl)-1-(3-methoxythiophen-2-yl)-N-methylethanamine
CID 105002642
2-(3-bromophenyl)-1-(3-bromothiophen-2-yl)-N-methylethanamine
CID 63797942
2-(3-methoxyphenyl)-N-methyl-1-(2-methylsulfanylphenyl)ethanamine
CID 79217018
N-[2-(3-methoxyphenyl)-1-thiophen-2-ylethyl]propan-2-amine
CID 3062037

Frequently Asked Questions

What is the IUPAC name of 2-(3-methoxyphenyl)-1-(3-methoxythiophen-2-yl)-N-methylethanamine?
The IUPAC name of 2-(3-methoxyphenyl)-1-(3-methoxythiophen-2-yl)-N-methylethanamine (CID 81121763) is 2-(3-methoxyphenyl)-1-(3-methoxythiophen-2-yl)-N-methylethanamine.
What is the SMILES notation for 2-(3-methoxyphenyl)-1-(3-methoxythiophen-2-yl)-N-methylethanamine?
The canonical SMILES for 2-(3-methoxyphenyl)-1-(3-methoxythiophen-2-yl)-N-methylethanamine is CNC(Cc1cccc(OC)c1)c1sccc1OC.
What is the InChIKey of 2-(3-methoxyphenyl)-1-(3-methoxythiophen-2-yl)-N-methylethanamine?
The InChIKey is XLDSXNIKIVWHGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19NO2S/c1-16-13(15-14(18-3)7-8-19-15)10-11-5-4-6-12(9-11)17-2/h4-9,13,16H,10H2,1-3H3.
What are the key properties of 2-(3-methoxyphenyl)-1-(3-methoxythiophen-2-yl)-N-methylethanamine?
2-(3-methoxyphenyl)-1-(3-methoxythiophen-2-yl)-N-methylethanamine has a molecular weight of 277.39 g/mol, XLogP of 3.27, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methoxyphenyl)-1-(3-methoxythiophen-2-yl)-N-methylethanamine is sourced from PubChem (CID 81121763), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).