5-(3-piperidin-1-ylpyrrolidin-1-yl)pyridin-3-amine

C14H22N4 — CID 113424017

IUPAC5-(3-piperidin-1-ylpyrrolidin-1-yl)pyridin-3-amine
SMILESNc1cncc(N2CCC(N3CCCCC3)C2)c1
InChIInChI=1S/C14H22N4/c15-12-8-14(10-16-9-12)18-7-4-13(11-18)17-5-2-1-3-6-17/h8-10,13H,1-7,11,15H2
InChIKeyOYLGRNFOLYVQAJ-UHFFFAOYSA-N
MW246.36 g/mol
LogP1.73
Rot. Bonds2

About 5-(3-piperidin-1-ylpyrrolidin-1-yl)pyridin-3-amine

5-(3-piperidin-1-ylpyrrolidin-1-yl)pyridin-3-amine (PubChem CID 113424017) has the molecular formula C14H22N4 and a molecular weight of 246.36 g/mol. Its IUPAC name is 5-(3-piperidin-1-ylpyrrolidin-1-yl)pyridin-3-amine.

Molecular Properties

Compound Name5-(3-piperidin-1-ylpyrrolidin-1-yl)pyridin-3-amine
PubChem CID113424017
Molecular FormulaC14H22N4
Molecular Weight246.36 g/mol
Exact Mass246.18
IUPAC Name5-(3-piperidin-1-ylpyrrolidin-1-yl)pyridin-3-amine
SMILESNc1cncc(N2CCC(N3CCCCC3)C2)c1
InChIInChI=1S/C14H22N4/c15-12-8-14(10-16-9-12)18-7-4-13(11-18)17-5-2-1-3-6-17/h8-10,13H,1-7,11,15H2
InChIKeyOYLGRNFOLYVQAJ-UHFFFAOYSA-N
XLogP1.73
TPSA45.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.36
LogP ≤ 51.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-(3-piperidin-1-ylpyrrolidin-1-yl)pyridin-3-amine?
The IUPAC name of 5-(3-piperidin-1-ylpyrrolidin-1-yl)pyridin-3-amine (CID 113424017) is 5-(3-piperidin-1-ylpyrrolidin-1-yl)pyridin-3-amine.
What is the SMILES notation for 5-(3-piperidin-1-ylpyrrolidin-1-yl)pyridin-3-amine?
The canonical SMILES for 5-(3-piperidin-1-ylpyrrolidin-1-yl)pyridin-3-amine is Nc1cncc(N2CCC(N3CCCCC3)C2)c1.
What is the InChIKey of 5-(3-piperidin-1-ylpyrrolidin-1-yl)pyridin-3-amine?
The InChIKey is OYLGRNFOLYVQAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N4/c15-12-8-14(10-16-9-12)18-7-4-13(11-18)17-5-2-1-3-6-17/h8-10,13H,1-7,11,15H2.
What are the key properties of 5-(3-piperidin-1-ylpyrrolidin-1-yl)pyridin-3-amine?
5-(3-piperidin-1-ylpyrrolidin-1-yl)pyridin-3-amine has a molecular weight of 246.36 g/mol, XLogP of 1.73, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(3-piperidin-1-ylpyrrolidin-1-yl)pyridin-3-amine is sourced from PubChem (CID 113424017), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).