8-(6-methyl-2-pyridinyl)-8-azabicyclo[3.2.1]octan-3-amine

C13H19N3 — CID 61235208

IUPAC8-(6-methyl-2-pyridinyl)-8-azabicyclo[3.2.1]octan-3-amine
SMILESCc1cccc(N2C3CCC2CC(N)C3)n1
InChIInChI=1S/C13H19N3/c1-9-3-2-4-13(15-9)16-11-5-6-12(16)8-10(14)7-11/h2-4,10-12H,5-8,14H2,1H3
InChIKeyJGEWQZLECZMOGP-UHFFFAOYSA-N
MW217.32 g/mol
LogP1.85
Rot. Bonds1

About 8-(6-methyl-2-pyridinyl)-8-azabicyclo[3.2.1]octan-3-amine

8-(6-methyl-2-pyridinyl)-8-azabicyclo[3.2.1]octan-3-amine (PubChem CID 61235208) has the molecular formula C13H19N3 and a molecular weight of 217.32 g/mol. Its IUPAC name is 8-(6-methyl-2-pyridinyl)-8-azabicyclo[3.2.1]octan-3-amine.

Molecular Properties

Compound Name8-(6-methyl-2-pyridinyl)-8-azabicyclo[3.2.1]octan-3-amine
PubChem CID61235208
Molecular FormulaC13H19N3
Molecular Weight217.32 g/mol
Exact Mass217.16
IUPAC Name8-(6-methyl-2-pyridinyl)-8-azabicyclo[3.2.1]octan-3-amine
SMILESCc1cccc(N2C3CCC2CC(N)C3)n1
InChIInChI=1S/C13H19N3/c1-9-3-2-4-13(15-9)16-11-5-6-12(16)8-10(14)7-11/h2-4,10-12H,5-8,14H2,1H3
InChIKeyJGEWQZLECZMOGP-UHFFFAOYSA-N
XLogP1.85
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.32
LogP ≤ 51.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 8-(6-methyl-2-pyridinyl)-8-azabicyclo[3.2.1]octan-3-amine?
The IUPAC name of 8-(6-methyl-2-pyridinyl)-8-azabicyclo[3.2.1]octan-3-amine (CID 61235208) is 8-(6-methyl-2-pyridinyl)-8-azabicyclo[3.2.1]octan-3-amine.
What is the SMILES notation for 8-(6-methyl-2-pyridinyl)-8-azabicyclo[3.2.1]octan-3-amine?
The canonical SMILES for 8-(6-methyl-2-pyridinyl)-8-azabicyclo[3.2.1]octan-3-amine is Cc1cccc(N2C3CCC2CC(N)C3)n1.
What is the InChIKey of 8-(6-methyl-2-pyridinyl)-8-azabicyclo[3.2.1]octan-3-amine?
The InChIKey is JGEWQZLECZMOGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3/c1-9-3-2-4-13(15-9)16-11-5-6-12(16)8-10(14)7-11/h2-4,10-12H,5-8,14H2,1H3.
What are the key properties of 8-(6-methyl-2-pyridinyl)-8-azabicyclo[3.2.1]octan-3-amine?
8-(6-methyl-2-pyridinyl)-8-azabicyclo[3.2.1]octan-3-amine has a molecular weight of 217.32 g/mol, XLogP of 1.85, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(6-methyl-2-pyridinyl)-8-azabicyclo[3.2.1]octan-3-amine is sourced from PubChem (CID 61235208), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).