N-methyl-1-[2-(thiophen-2-ylmethoxy)-3-pyridinyl]ethanamine

C13H16N2OS — CID 114056691

IUPACN-methyl-1-[2-(thiophen-2-ylmethoxy)-3-pyridinyl]ethanamine
SMILESCNC(C)c1cccnc1OCc1cccs1
InChIInChI=1S/C13H16N2OS/c1-10(14-2)12-6-3-7-15-13(12)16-9-11-5-4-8-17-11/h3-8,10,14H,9H2,1-2H3
InChIKeyGURQUSZJEWMJFK-UHFFFAOYSA-N
MW248.35 g/mol
LogP3.00
Rot. Bonds5

About N-methyl-1-[2-(thiophen-2-ylmethoxy)-3-pyridinyl]ethanamine

N-methyl-1-[2-(thiophen-2-ylmethoxy)-3-pyridinyl]ethanamine (PubChem CID 114056691) has the molecular formula C13H16N2OS and a molecular weight of 248.35 g/mol. Its IUPAC name is N-methyl-1-[2-(thiophen-2-ylmethoxy)-3-pyridinyl]ethanamine.

Molecular Properties

Compound NameN-methyl-1-[2-(thiophen-2-ylmethoxy)-3-pyridinyl]ethanamine
PubChem CID114056691
Molecular FormulaC13H16N2OS
Molecular Weight248.35 g/mol
Exact Mass248.10
IUPAC NameN-methyl-1-[2-(thiophen-2-ylmethoxy)-3-pyridinyl]ethanamine
SMILESCNC(C)c1cccnc1OCc1cccs1
InChIInChI=1S/C13H16N2OS/c1-10(14-2)12-6-3-7-15-13(12)16-9-11-5-4-8-17-11/h3-8,10,14H,9H2,1-2H3
InChIKeyGURQUSZJEWMJFK-UHFFFAOYSA-N
XLogP3.00
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.35
LogP ≤ 53.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(1R)-1-(2-methoxy-3-pyridinyl)-N-methylethanamine
CID 55276659
N-methyl-1-[2-(4,4,4-trifluorobutoxy)-3-pyridinyl]ethanamine
CID 114056754
1-[2-(2-butoxyethoxy)-3-pyridinyl]-N-methylethanamine
CID 114056646
1-[3-fluoro-2-(thiophen-2-ylmethoxy)-4-pyridinyl]-N-methylmethanamine
CID 105391405
[1-(2-methoxy-3-pyridinyl)-2-thiophen-2-ylethyl]hydrazine
CID 105295492
N-[[3-fluoro-2-(thiophen-2-ylmethoxy)-4-pyridinyl]methyl]-2-methylpropan-1-amine
CID 105391402
[3-(thiophen-2-ylmethoxy)pyrazin-2-yl]methanamine
CID 62684174
2-bromo-3-(thiophen-2-ylmethoxy)pyridine
CID 65101746
1-[5-chloro-2-(2-thiophen-2-ylethoxy)phenyl]-N-methylethanamine
CID 63775283
2-ethoxy-N-(thiophen-2-ylmethyl)pyridin-3-amine
CID 43706255
N-methyl-8-(thiophen-2-ylmethoxy)imidazo[1,2-a]pyrazin-6-amine
CID 80872591
5-methyl-2-propan-2-yl-6-(thiophen-2-ylmethoxy)pyrimidin-4-amine
CID 80990262

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-[2-(thiophen-2-ylmethoxy)-3-pyridinyl]ethanamine?
The IUPAC name of N-methyl-1-[2-(thiophen-2-ylmethoxy)-3-pyridinyl]ethanamine (CID 114056691) is N-methyl-1-[2-(thiophen-2-ylmethoxy)-3-pyridinyl]ethanamine.
What is the SMILES notation for N-methyl-1-[2-(thiophen-2-ylmethoxy)-3-pyridinyl]ethanamine?
The canonical SMILES for N-methyl-1-[2-(thiophen-2-ylmethoxy)-3-pyridinyl]ethanamine is CNC(C)c1cccnc1OCc1cccs1.
What is the InChIKey of N-methyl-1-[2-(thiophen-2-ylmethoxy)-3-pyridinyl]ethanamine?
The InChIKey is GURQUSZJEWMJFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N2OS/c1-10(14-2)12-6-3-7-15-13(12)16-9-11-5-4-8-17-11/h3-8,10,14H,9H2,1-2H3.
What are the key properties of N-methyl-1-[2-(thiophen-2-ylmethoxy)-3-pyridinyl]ethanamine?
N-methyl-1-[2-(thiophen-2-ylmethoxy)-3-pyridinyl]ethanamine has a molecular weight of 248.35 g/mol, XLogP of 3.00, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-[2-(thiophen-2-ylmethoxy)-3-pyridinyl]ethanamine is sourced from PubChem (CID 114056691), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).