1-[6-(2-ethyl-5-methylpyrrolidin-1-yl)-2-methyl-3-pyridinyl]-N-methylmethanamine

C15H25N3 — CID 83221303

IUPAC1-[6-(2-ethyl-5-methylpyrrolidin-1-yl)-2-methyl-3-pyridinyl]-N-methylmethanamine
SMILESCCC1CCC(C)N1c1ccc(CNC)c(C)n1
InChIInChI=1S/C15H25N3/c1-5-14-8-6-11(2)18(14)15-9-7-13(10-16-4)12(3)17-15/h7,9,11,14,16H,5-6,8,10H2,1-4H3
InChIKeyWVVZNGIDAYOQJL-UHFFFAOYSA-N
MW247.39 g/mol
LogP2.88
Rot. Bonds4

About 1-[6-(2-ethyl-5-methylpyrrolidin-1-yl)-2-methyl-3-pyridinyl]-N-methylmethanamine

1-[6-(2-ethyl-5-methylpyrrolidin-1-yl)-2-methyl-3-pyridinyl]-N-methylmethanamine (PubChem CID 83221303) has the molecular formula C15H25N3 and a molecular weight of 247.39 g/mol. Its IUPAC name is 1-[6-(2-ethyl-5-methylpyrrolidin-1-yl)-2-methyl-3-pyridinyl]-N-methylmethanamine.

Molecular Properties

Compound Name1-[6-(2-ethyl-5-methylpyrrolidin-1-yl)-2-methyl-3-pyridinyl]-N-methylmethanamine
PubChem CID83221303
Molecular FormulaC15H25N3
Molecular Weight247.39 g/mol
Exact Mass247.20
IUPAC Name1-[6-(2-ethyl-5-methylpyrrolidin-1-yl)-2-methyl-3-pyridinyl]-N-methylmethanamine
SMILESCCC1CCC(C)N1c1ccc(CNC)c(C)n1
InChIInChI=1S/C15H25N3/c1-5-14-8-6-11(2)18(14)15-9-7-13(10-16-4)12(3)17-15/h7,9,11,14,16H,5-6,8,10H2,1-4H3
InChIKeyWVVZNGIDAYOQJL-UHFFFAOYSA-N
XLogP2.88
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.39
LogP ≤ 52.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-[6-(2-ethyl-5-methylpyrrolidin-1-yl)-2-methyl-3-pyridinyl]-N-methylmethanamine?
The IUPAC name of 1-[6-(2-ethyl-5-methylpyrrolidin-1-yl)-2-methyl-3-pyridinyl]-N-methylmethanamine (CID 83221303) is 1-[6-(2-ethyl-5-methylpyrrolidin-1-yl)-2-methyl-3-pyridinyl]-N-methylmethanamine.
What is the SMILES notation for 1-[6-(2-ethyl-5-methylpyrrolidin-1-yl)-2-methyl-3-pyridinyl]-N-methylmethanamine?
The canonical SMILES for 1-[6-(2-ethyl-5-methylpyrrolidin-1-yl)-2-methyl-3-pyridinyl]-N-methylmethanamine is CCC1CCC(C)N1c1ccc(CNC)c(C)n1.
What is the InChIKey of 1-[6-(2-ethyl-5-methylpyrrolidin-1-yl)-2-methyl-3-pyridinyl]-N-methylmethanamine?
The InChIKey is WVVZNGIDAYOQJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3/c1-5-14-8-6-11(2)18(14)15-9-7-13(10-16-4)12(3)17-15/h7,9,11,14,16H,5-6,8,10H2,1-4H3.
What are the key properties of 1-[6-(2-ethyl-5-methylpyrrolidin-1-yl)-2-methyl-3-pyridinyl]-N-methylmethanamine?
1-[6-(2-ethyl-5-methylpyrrolidin-1-yl)-2-methyl-3-pyridinyl]-N-methylmethanamine has a molecular weight of 247.39 g/mol, XLogP of 2.88, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[6-(2-ethyl-5-methylpyrrolidin-1-yl)-2-methyl-3-pyridinyl]-N-methylmethanamine is sourced from PubChem (CID 83221303), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).