2-methoxy-N-[(4-methoxy-2-pyridinyl)methyl]-N-(thiophen-3-ylmethyl)ethanamine

C15H20N2O2S — CID 91834045

IUPAC2-methoxy-N-[(4-methoxy-2-pyridinyl)methyl]-N-(thiophen-3-ylmethyl)ethanamine
SMILESCOCCN(Cc1ccsc1)Cc1cc(OC)ccn1
InChIInChI=1S/C15H20N2O2S/c1-18-7-6-17(10-13-4-8-20-12-13)11-14-9-15(19-2)3-5-16-14/h3-5,8-9,12H,6-7,10-11H2,1-2H3
InChIKeyVIDFDWXQDLKLDB-UHFFFAOYSA-N
MW292.40 g/mol
LogP2.80
Rot. Bonds8

About 2-methoxy-N-[(4-methoxy-2-pyridinyl)methyl]-N-(thiophen-3-ylmethyl)ethanamine

2-methoxy-N-[(4-methoxy-2-pyridinyl)methyl]-N-(thiophen-3-ylmethyl)ethanamine (PubChem CID 91834045) has the molecular formula C15H20N2O2S and a molecular weight of 292.40 g/mol. Its IUPAC name is 2-methoxy-N-[(4-methoxy-2-pyridinyl)methyl]-N-(thiophen-3-ylmethyl)ethanamine.

Molecular Properties

Compound Name2-methoxy-N-[(4-methoxy-2-pyridinyl)methyl]-N-(thiophen-3-ylmethyl)ethanamine
PubChem CID91834045
Molecular FormulaC15H20N2O2S
Molecular Weight292.40 g/mol
Exact Mass292.12
IUPAC Name2-methoxy-N-[(4-methoxy-2-pyridinyl)methyl]-N-(thiophen-3-ylmethyl)ethanamine
SMILESCOCCN(Cc1ccsc1)Cc1cc(OC)ccn1
InChIInChI=1S/C15H20N2O2S/c1-18-7-6-17(10-13-4-8-20-12-13)11-14-9-15(19-2)3-5-16-14/h3-5,8-9,12H,6-7,10-11H2,1-2H3
InChIKeyVIDFDWXQDLKLDB-UHFFFAOYSA-N
XLogP2.80
TPSA34.59 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.40
LogP ≤ 52.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-[(4-methoxy-2-pyridinyl)methyl]-N-(thiophen-3-ylmethyl)ethanamine?
The IUPAC name of 2-methoxy-N-[(4-methoxy-2-pyridinyl)methyl]-N-(thiophen-3-ylmethyl)ethanamine (CID 91834045) is 2-methoxy-N-[(4-methoxy-2-pyridinyl)methyl]-N-(thiophen-3-ylmethyl)ethanamine.
What is the SMILES notation for 2-methoxy-N-[(4-methoxy-2-pyridinyl)methyl]-N-(thiophen-3-ylmethyl)ethanamine?
The canonical SMILES for 2-methoxy-N-[(4-methoxy-2-pyridinyl)methyl]-N-(thiophen-3-ylmethyl)ethanamine is COCCN(Cc1ccsc1)Cc1cc(OC)ccn1.
What is the InChIKey of 2-methoxy-N-[(4-methoxy-2-pyridinyl)methyl]-N-(thiophen-3-ylmethyl)ethanamine?
The InChIKey is VIDFDWXQDLKLDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O2S/c1-18-7-6-17(10-13-4-8-20-12-13)11-14-9-15(19-2)3-5-16-14/h3-5,8-9,12H,6-7,10-11H2,1-2H3.
What are the key properties of 2-methoxy-N-[(4-methoxy-2-pyridinyl)methyl]-N-(thiophen-3-ylmethyl)ethanamine?
2-methoxy-N-[(4-methoxy-2-pyridinyl)methyl]-N-(thiophen-3-ylmethyl)ethanamine has a molecular weight of 292.40 g/mol, XLogP of 2.80, 8 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-[(4-methoxy-2-pyridinyl)methyl]-N-(thiophen-3-ylmethyl)ethanamine is sourced from PubChem (CID 91834045), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).