2-(2,3,5-trimethylpiperidin-1-yl)pyridin-3-amine

C13H21N3 — CID 114591996

IUPAC2-(2,3,5-trimethylpiperidin-1-yl)pyridin-3-amine
SMILESCC1CC(C)C(C)N(c2ncccc2N)C1
InChIInChI=1S/C13H21N3/c1-9-7-10(2)11(3)16(8-9)13-12(14)5-4-6-15-13/h4-6,9-11H,7-8,14H2,1-3H3
InChIKeyBZVRCYTUAAZNQG-UHFFFAOYSA-N
MW219.33 g/mol
LogP2.53
Rot. Bonds1

About 2-(2,3,5-trimethylpiperidin-1-yl)pyridin-3-amine

2-(2,3,5-trimethylpiperidin-1-yl)pyridin-3-amine (PubChem CID 114591996) has the molecular formula C13H21N3 and a molecular weight of 219.33 g/mol. Its IUPAC name is 2-(2,3,5-trimethylpiperidin-1-yl)pyridin-3-amine.

Molecular Properties

Compound Name2-(2,3,5-trimethylpiperidin-1-yl)pyridin-3-amine
PubChem CID114591996
Molecular FormulaC13H21N3
Molecular Weight219.33 g/mol
Exact Mass219.17
IUPAC Name2-(2,3,5-trimethylpiperidin-1-yl)pyridin-3-amine
SMILESCC1CC(C)C(C)N(c2ncccc2N)C1
InChIInChI=1S/C13H21N3/c1-9-7-10(2)11(3)16(8-9)13-12(14)5-4-6-15-13/h4-6,9-11H,7-8,14H2,1-3H3
InChIKeyBZVRCYTUAAZNQG-UHFFFAOYSA-N
XLogP2.53
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 ≤ 52.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(2,3,5-trimethylpiperidin-1-yl)pyridin-3-amine?
The IUPAC name of 2-(2,3,5-trimethylpiperidin-1-yl)pyridin-3-amine (CID 114591996) is 2-(2,3,5-trimethylpiperidin-1-yl)pyridin-3-amine.
What is the SMILES notation for 2-(2,3,5-trimethylpiperidin-1-yl)pyridin-3-amine?
The canonical SMILES for 2-(2,3,5-trimethylpiperidin-1-yl)pyridin-3-amine is CC1CC(C)C(C)N(c2ncccc2N)C1.
What is the InChIKey of 2-(2,3,5-trimethylpiperidin-1-yl)pyridin-3-amine?
The InChIKey is BZVRCYTUAAZNQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3/c1-9-7-10(2)11(3)16(8-9)13-12(14)5-4-6-15-13/h4-6,9-11H,7-8,14H2,1-3H3.
What are the key properties of 2-(2,3,5-trimethylpiperidin-1-yl)pyridin-3-amine?
2-(2,3,5-trimethylpiperidin-1-yl)pyridin-3-amine has a molecular weight of 219.33 g/mol, XLogP of 2.53, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3,5-trimethylpiperidin-1-yl)pyridin-3-amine is sourced from PubChem (CID 114591996), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).