2-(6-methoxy-2-pyridinyl)-N-methyl-1-phenylethanamine

C15H18N2O — CID 63586131

IUPAC2-(6-methoxy-2-pyridinyl)-N-methyl-1-phenylethanamine
SMILESCNC(Cc1cccc(OC)n1)c1ccccc1
InChIInChI=1S/C15H18N2O/c1-16-14(12-7-4-3-5-8-12)11-13-9-6-10-15(17-13)18-2/h3-10,14,16H,11H2,1-2H3
InChIKeyKNACNGIDZQLAAR-UHFFFAOYSA-N
MW242.32 g/mol
LogP2.59
Rot. Bonds5

About 2-(6-methoxy-2-pyridinyl)-N-methyl-1-phenylethanamine

2-(6-methoxy-2-pyridinyl)-N-methyl-1-phenylethanamine (PubChem CID 63586131) has the molecular formula C15H18N2O and a molecular weight of 242.32 g/mol. Its IUPAC name is 2-(6-methoxy-2-pyridinyl)-N-methyl-1-phenylethanamine.

Molecular Properties

Compound Name2-(6-methoxy-2-pyridinyl)-N-methyl-1-phenylethanamine
PubChem CID63586131
Molecular FormulaC15H18N2O
Molecular Weight242.32 g/mol
Exact Mass242.14
IUPAC Name2-(6-methoxy-2-pyridinyl)-N-methyl-1-phenylethanamine
SMILESCNC(Cc1cccc(OC)n1)c1ccccc1
InChIInChI=1S/C15H18N2O/c1-16-14(12-7-4-3-5-8-12)11-13-9-6-10-15(17-13)18-2/h3-10,14,16H,11H2,1-2H3
InChIKeyKNACNGIDZQLAAR-UHFFFAOYSA-N
XLogP2.59
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.32
LogP ≤ 52.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(6-methoxy-2-pyridinyl)-N-methyl-1-phenylethanamine?
The IUPAC name of 2-(6-methoxy-2-pyridinyl)-N-methyl-1-phenylethanamine (CID 63586131) is 2-(6-methoxy-2-pyridinyl)-N-methyl-1-phenylethanamine.
What is the SMILES notation for 2-(6-methoxy-2-pyridinyl)-N-methyl-1-phenylethanamine?
The canonical SMILES for 2-(6-methoxy-2-pyridinyl)-N-methyl-1-phenylethanamine is CNC(Cc1cccc(OC)n1)c1ccccc1.
What is the InChIKey of 2-(6-methoxy-2-pyridinyl)-N-methyl-1-phenylethanamine?
The InChIKey is KNACNGIDZQLAAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O/c1-16-14(12-7-4-3-5-8-12)11-13-9-6-10-15(17-13)18-2/h3-10,14,16H,11H2,1-2H3.
What are the key properties of 2-(6-methoxy-2-pyridinyl)-N-methyl-1-phenylethanamine?
2-(6-methoxy-2-pyridinyl)-N-methyl-1-phenylethanamine has a molecular weight of 242.32 g/mol, XLogP of 2.59, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6-methoxy-2-pyridinyl)-N-methyl-1-phenylethanamine is sourced from PubChem (CID 63586131), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).