2-(azocan-1-yl)pyridin-3-amine

C12H19N3 — CID 28799710

IUPAC2-(azocan-1-yl)pyridin-3-amine
SMILESNc1cccnc1N1CCCCCCC1
InChIInChI=1S/C12H19N3/c13-11-7-6-8-14-12(11)15-9-4-2-1-3-5-10-15/h6-8H,1-5,9-10,13H2
InChIKeyDGJOKENCBNBLIZ-UHFFFAOYSA-N
MW205.31 g/mol
LogP2.43
Rot. Bonds1

About 2-(azocan-1-yl)pyridin-3-amine

2-(azocan-1-yl)pyridin-3-amine (PubChem CID 28799710) has the molecular formula C12H19N3 and a molecular weight of 205.31 g/mol. Its IUPAC name is 2-(azocan-1-yl)pyridin-3-amine.

Molecular Properties

Compound Name2-(azocan-1-yl)pyridin-3-amine
PubChem CID28799710
Molecular FormulaC12H19N3
Molecular Weight205.31 g/mol
Exact Mass205.16
IUPAC Name2-(azocan-1-yl)pyridin-3-amine
SMILESNc1cccnc1N1CCCCCCC1
InChIInChI=1S/C12H19N3/c13-11-7-6-8-14-12(11)15-9-4-2-1-3-5-10-15/h6-8H,1-5,9-10,13H2
InChIKeyDGJOKENCBNBLIZ-UHFFFAOYSA-N
XLogP2.43
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.31
LogP ≤ 52.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-(azocan-1-yl)pyridin-3-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-(azocan-1-yl)pyridin-3-amine?
The IUPAC name of 2-(azocan-1-yl)pyridin-3-amine (CID 28799710) is 2-(azocan-1-yl)pyridin-3-amine.
What is the SMILES notation for 2-(azocan-1-yl)pyridin-3-amine?
The canonical SMILES for 2-(azocan-1-yl)pyridin-3-amine is Nc1cccnc1N1CCCCCCC1.
What is the InChIKey of 2-(azocan-1-yl)pyridin-3-amine?
The InChIKey is DGJOKENCBNBLIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3/c13-11-7-6-8-14-12(11)15-9-4-2-1-3-5-10-15/h6-8H,1-5,9-10,13H2.
What are the key properties of 2-(azocan-1-yl)pyridin-3-amine?
2-(azocan-1-yl)pyridin-3-amine has a molecular weight of 205.31 g/mol, XLogP of 2.43, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(azocan-1-yl)pyridin-3-amine is sourced from PubChem (CID 28799710), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).