1-methoxy-N-(2-methoxyethyl)-N-[[6-(methylaminomethyl)-2-pyridinyl]methyl]propan-2-amine

C15H27N3O2 — CID 106906404

IUPAC1-methoxy-N-(2-methoxyethyl)-N-[[6-(methylaminomethyl)-2-pyridinyl]methyl]propan-2-amine
SMILESCNCc1cccc(CN(CCOC)C(C)COC)n1
InChIInChI=1S/C15H27N3O2/c1-13(12-20-4)18(8-9-19-3)11-15-7-5-6-14(17-15)10-16-2/h5-7,13,16H,8-12H2,1-4H3
InChIKeyCTNYWRRCDWRGQY-UHFFFAOYSA-N
MW281.40 g/mol
LogP1.28
Rot. Bonds10

About 1-methoxy-N-(2-methoxyethyl)-N-[[6-(methylaminomethyl)-2-pyridinyl]methyl]propan-2-amine

1-methoxy-N-(2-methoxyethyl)-N-[[6-(methylaminomethyl)-2-pyridinyl]methyl]propan-2-amine (PubChem CID 106906404) has the molecular formula C15H27N3O2 and a molecular weight of 281.40 g/mol. Its IUPAC name is 1-methoxy-N-(2-methoxyethyl)-N-[[6-(methylaminomethyl)-2-pyridinyl]methyl]propan-2-amine.

Molecular Properties

Compound Name1-methoxy-N-(2-methoxyethyl)-N-[[6-(methylaminomethyl)-2-pyridinyl]methyl]propan-2-amine
PubChem CID106906404
Molecular FormulaC15H27N3O2
Molecular Weight281.40 g/mol
Exact Mass281.21
IUPAC Name1-methoxy-N-(2-methoxyethyl)-N-[[6-(methylaminomethyl)-2-pyridinyl]methyl]propan-2-amine
SMILESCNCc1cccc(CN(CCOC)C(C)COC)n1
InChIInChI=1S/C15H27N3O2/c1-13(12-20-4)18(8-9-19-3)11-15-7-5-6-14(17-15)10-16-2/h5-7,13,16H,8-12H2,1-4H3
InChIKeyCTNYWRRCDWRGQY-UHFFFAOYSA-N
XLogP1.28
TPSA46.62 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds10
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.40
LogP ≤ 51.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-methoxy-N-(2-methoxyethyl)-N-[[6-(methylaminomethyl)-2-pyridinyl]methyl]propan-2-amine?
The IUPAC name of 1-methoxy-N-(2-methoxyethyl)-N-[[6-(methylaminomethyl)-2-pyridinyl]methyl]propan-2-amine (CID 106906404) is 1-methoxy-N-(2-methoxyethyl)-N-[[6-(methylaminomethyl)-2-pyridinyl]methyl]propan-2-amine.
What is the SMILES notation for 1-methoxy-N-(2-methoxyethyl)-N-[[6-(methylaminomethyl)-2-pyridinyl]methyl]propan-2-amine?
The canonical SMILES for 1-methoxy-N-(2-methoxyethyl)-N-[[6-(methylaminomethyl)-2-pyridinyl]methyl]propan-2-amine is CNCc1cccc(CN(CCOC)C(C)COC)n1.
What is the InChIKey of 1-methoxy-N-(2-methoxyethyl)-N-[[6-(methylaminomethyl)-2-pyridinyl]methyl]propan-2-amine?
The InChIKey is CTNYWRRCDWRGQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27N3O2/c1-13(12-20-4)18(8-9-19-3)11-15-7-5-6-14(17-15)10-16-2/h5-7,13,16H,8-12H2,1-4H3.
What are the key properties of 1-methoxy-N-(2-methoxyethyl)-N-[[6-(methylaminomethyl)-2-pyridinyl]methyl]propan-2-amine?
1-methoxy-N-(2-methoxyethyl)-N-[[6-(methylaminomethyl)-2-pyridinyl]methyl]propan-2-amine has a molecular weight of 281.40 g/mol, XLogP of 1.28, 10 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methoxy-N-(2-methoxyethyl)-N-[[6-(methylaminomethyl)-2-pyridinyl]methyl]propan-2-amine is sourced from PubChem (CID 106906404), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).