2-(2,5-dimethylpiperidin-1-yl)-6-methylpyridin-3-amine

C13H21N3 — CID 81132345

IUPAC2-(2,5-dimethylpiperidin-1-yl)-6-methylpyridin-3-amine
SMILESCc1ccc(N)c(N2CC(C)CCC2C)n1
InChIInChI=1S/C13H21N3/c1-9-4-6-11(3)16(8-9)13-12(14)7-5-10(2)15-13/h5,7,9,11H,4,6,8,14H2,1-3H3
InChIKeyBVFIFJPHXMWEMF-UHFFFAOYSA-N
MW219.33 g/mol
LogP2.60
Rot. Bonds1

About 2-(2,5-dimethylpiperidin-1-yl)-6-methylpyridin-3-amine

2-(2,5-dimethylpiperidin-1-yl)-6-methylpyridin-3-amine (PubChem CID 81132345) has the molecular formula C13H21N3 and a molecular weight of 219.33 g/mol. Its IUPAC name is 2-(2,5-dimethylpiperidin-1-yl)-6-methylpyridin-3-amine.

Molecular Properties

Compound Name2-(2,5-dimethylpiperidin-1-yl)-6-methylpyridin-3-amine
PubChem CID81132345
Molecular FormulaC13H21N3
Molecular Weight219.33 g/mol
Exact Mass219.17
IUPAC Name2-(2,5-dimethylpiperidin-1-yl)-6-methylpyridin-3-amine
SMILESCc1ccc(N)c(N2CC(C)CCC2C)n1
InChIInChI=1S/C13H21N3/c1-9-4-6-11(3)16(8-9)13-12(14)7-5-10(2)15-13/h5,7,9,11H,4,6,8,14H2,1-3H3
InChIKeyBVFIFJPHXMWEMF-UHFFFAOYSA-N
XLogP2.60
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.33
LogP ≤ 52.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(2,5-dimethylpiperidin-1-yl)-6-methylpyridin-3-amine?
The IUPAC name of 2-(2,5-dimethylpiperidin-1-yl)-6-methylpyridin-3-amine (CID 81132345) is 2-(2,5-dimethylpiperidin-1-yl)-6-methylpyridin-3-amine.
What is the SMILES notation for 2-(2,5-dimethylpiperidin-1-yl)-6-methylpyridin-3-amine?
The canonical SMILES for 2-(2,5-dimethylpiperidin-1-yl)-6-methylpyridin-3-amine is Cc1ccc(N)c(N2CC(C)CCC2C)n1.
What is the InChIKey of 2-(2,5-dimethylpiperidin-1-yl)-6-methylpyridin-3-amine?
The InChIKey is BVFIFJPHXMWEMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3/c1-9-4-6-11(3)16(8-9)13-12(14)7-5-10(2)15-13/h5,7,9,11H,4,6,8,14H2,1-3H3.
What are the key properties of 2-(2,5-dimethylpiperidin-1-yl)-6-methylpyridin-3-amine?
2-(2,5-dimethylpiperidin-1-yl)-6-methylpyridin-3-amine has a molecular weight of 219.33 g/mol, XLogP of 2.60, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,5-dimethylpiperidin-1-yl)-6-methylpyridin-3-amine is sourced from PubChem (CID 81132345), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).