1-methoxy-N-[(4-methoxy-6-methyl-2-pyridinyl)methyl]propan-2-amine

C12H20N2O2 — CID 82892971

IUPAC1-methoxy-N-[(4-methoxy-6-methyl-2-pyridinyl)methyl]propan-2-amine
SMILESCOCC(C)NCc1cc(OC)cc(C)n1
InChIInChI=1S/C12H20N2O2/c1-9-5-12(16-4)6-11(14-9)7-13-10(2)8-15-3/h5-6,10,13H,7-8H2,1-4H3
InChIKeyUQYXFQWLCLEGEZ-UHFFFAOYSA-N
MW224.30 g/mol
LogP1.52
Rot. Bonds6

About 1-methoxy-N-[(4-methoxy-6-methyl-2-pyridinyl)methyl]propan-2-amine

1-methoxy-N-[(4-methoxy-6-methyl-2-pyridinyl)methyl]propan-2-amine (PubChem CID 82892971) has the molecular formula C12H20N2O2 and a molecular weight of 224.30 g/mol. Its IUPAC name is 1-methoxy-N-[(4-methoxy-6-methyl-2-pyridinyl)methyl]propan-2-amine.

Molecular Properties

Compound Name1-methoxy-N-[(4-methoxy-6-methyl-2-pyridinyl)methyl]propan-2-amine
PubChem CID82892971
Molecular FormulaC12H20N2O2
Molecular Weight224.30 g/mol
Exact Mass224.15
IUPAC Name1-methoxy-N-[(4-methoxy-6-methyl-2-pyridinyl)methyl]propan-2-amine
SMILESCOCC(C)NCc1cc(OC)cc(C)n1
InChIInChI=1S/C12H20N2O2/c1-9-5-12(16-4)6-11(14-9)7-13-10(2)8-15-3/h5-6,10,13H,7-8H2,1-4H3
InChIKeyUQYXFQWLCLEGEZ-UHFFFAOYSA-N
XLogP1.52
TPSA43.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.30
LogP ≤ 51.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-methoxy-N-[(4-methoxy-6-methyl-2-pyridinyl)methyl]propan-2-amine?
The IUPAC name of 1-methoxy-N-[(4-methoxy-6-methyl-2-pyridinyl)methyl]propan-2-amine (CID 82892971) is 1-methoxy-N-[(4-methoxy-6-methyl-2-pyridinyl)methyl]propan-2-amine.
What is the SMILES notation for 1-methoxy-N-[(4-methoxy-6-methyl-2-pyridinyl)methyl]propan-2-amine?
The canonical SMILES for 1-methoxy-N-[(4-methoxy-6-methyl-2-pyridinyl)methyl]propan-2-amine is COCC(C)NCc1cc(OC)cc(C)n1.
What is the InChIKey of 1-methoxy-N-[(4-methoxy-6-methyl-2-pyridinyl)methyl]propan-2-amine?
The InChIKey is UQYXFQWLCLEGEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2O2/c1-9-5-12(16-4)6-11(14-9)7-13-10(2)8-15-3/h5-6,10,13H,7-8H2,1-4H3.
What are the key properties of 1-methoxy-N-[(4-methoxy-6-methyl-2-pyridinyl)methyl]propan-2-amine?
1-methoxy-N-[(4-methoxy-6-methyl-2-pyridinyl)methyl]propan-2-amine has a molecular weight of 224.30 g/mol, XLogP of 1.52, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methoxy-N-[(4-methoxy-6-methyl-2-pyridinyl)methyl]propan-2-amine is sourced from PubChem (CID 82892971), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).