6-(2-ethyl-5-methylpyrrolidin-1-yl)-N-methylpyridin-2-amine

C13H21N3 — CID 83224477

IUPAC6-(2-ethyl-5-methylpyrrolidin-1-yl)-N-methylpyridin-2-amine
SMILESCCC1CCC(C)N1c1cccc(NC)n1
InChIInChI=1S/C13H21N3/c1-4-11-9-8-10(2)16(11)13-7-5-6-12(14-3)15-13/h5-7,10-11H,4,8-9H2,1-3H3,(H,14,15)
InChIKeyPDWKHXNOAFCGLS-UHFFFAOYSA-N
MW219.33 g/mol
LogP2.89
Rot. Bonds3

About 6-(2-ethyl-5-methylpyrrolidin-1-yl)-N-methylpyridin-2-amine

6-(2-ethyl-5-methylpyrrolidin-1-yl)-N-methylpyridin-2-amine (PubChem CID 83224477) has the molecular formula C13H21N3 and a molecular weight of 219.33 g/mol. Its IUPAC name is 6-(2-ethyl-5-methylpyrrolidin-1-yl)-N-methylpyridin-2-amine.

Molecular Properties

Compound Name6-(2-ethyl-5-methylpyrrolidin-1-yl)-N-methylpyridin-2-amine
PubChem CID83224477
Molecular FormulaC13H21N3
Molecular Weight219.33 g/mol
Exact Mass219.17
IUPAC Name6-(2-ethyl-5-methylpyrrolidin-1-yl)-N-methylpyridin-2-amine
SMILESCCC1CCC(C)N1c1cccc(NC)n1
InChIInChI=1S/C13H21N3/c1-4-11-9-8-10(2)16(11)13-7-5-6-12(14-3)15-13/h5-7,10-11H,4,8-9H2,1-3H3,(H,14,15)
InChIKeyPDWKHXNOAFCGLS-UHFFFAOYSA-N
XLogP2.89
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.33
LogP ≤ 52.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-(2-ethyl-5-methylpyrrolidin-1-yl)-N-methylpyridin-2-amine?
The IUPAC name of 6-(2-ethyl-5-methylpyrrolidin-1-yl)-N-methylpyridin-2-amine (CID 83224477) is 6-(2-ethyl-5-methylpyrrolidin-1-yl)-N-methylpyridin-2-amine.
What is the SMILES notation for 6-(2-ethyl-5-methylpyrrolidin-1-yl)-N-methylpyridin-2-amine?
The canonical SMILES for 6-(2-ethyl-5-methylpyrrolidin-1-yl)-N-methylpyridin-2-amine is CCC1CCC(C)N1c1cccc(NC)n1.
What is the InChIKey of 6-(2-ethyl-5-methylpyrrolidin-1-yl)-N-methylpyridin-2-amine?
The InChIKey is PDWKHXNOAFCGLS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3/c1-4-11-9-8-10(2)16(11)13-7-5-6-12(14-3)15-13/h5-7,10-11H,4,8-9H2,1-3H3,(H,14,15).
What are the key properties of 6-(2-ethyl-5-methylpyrrolidin-1-yl)-N-methylpyridin-2-amine?
6-(2-ethyl-5-methylpyrrolidin-1-yl)-N-methylpyridin-2-amine has a molecular weight of 219.33 g/mol, XLogP of 2.89, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-ethyl-5-methylpyrrolidin-1-yl)-N-methylpyridin-2-amine is sourced from PubChem (CID 83224477), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).