6-(piperidin-4-ylamino)pyridine-2-carbonitrile

C11H14N4 — CID 64589581

IUPAC6-(piperidin-4-ylamino)pyridine-2-carbonitrile
SMILESN#Cc1cccc(NC2CCNCC2)n1
InChIInChI=1S/C11H14N4/c12-8-10-2-1-3-11(15-10)14-9-4-6-13-7-5-9/h1-3,9,13H,4-7H2,(H,14,15)
InChIKeyDLXDBGKDKJEUIJ-UHFFFAOYSA-N
MW202.26 g/mol
LogP1.12
Rot. Bonds2

About 6-(piperidin-4-ylamino)pyridine-2-carbonitrile

6-(piperidin-4-ylamino)pyridine-2-carbonitrile (PubChem CID 64589581) has the molecular formula C11H14N4 and a molecular weight of 202.26 g/mol. Its IUPAC name is 6-(piperidin-4-ylamino)pyridine-2-carbonitrile.

Molecular Properties

Compound Name6-(piperidin-4-ylamino)pyridine-2-carbonitrile
PubChem CID64589581
Molecular FormulaC11H14N4
Molecular Weight202.26 g/mol
Exact Mass202.12
IUPAC Name6-(piperidin-4-ylamino)pyridine-2-carbonitrile
SMILESN#Cc1cccc(NC2CCNCC2)n1
InChIInChI=1S/C11H14N4/c12-8-10-2-1-3-11(15-10)14-9-4-6-13-7-5-9/h1-3,9,13H,4-7H2,(H,14,15)
InChIKeyDLXDBGKDKJEUIJ-UHFFFAOYSA-N
XLogP1.12
TPSA60.74 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.26
LogP ≤ 51.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-(piperidin-4-ylamino)pyridine-2-carbonitrile?
The IUPAC name of 6-(piperidin-4-ylamino)pyridine-2-carbonitrile (CID 64589581) is 6-(piperidin-4-ylamino)pyridine-2-carbonitrile.
What is the SMILES notation for 6-(piperidin-4-ylamino)pyridine-2-carbonitrile?
The canonical SMILES for 6-(piperidin-4-ylamino)pyridine-2-carbonitrile is N#Cc1cccc(NC2CCNCC2)n1.
What is the InChIKey of 6-(piperidin-4-ylamino)pyridine-2-carbonitrile?
The InChIKey is DLXDBGKDKJEUIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N4/c12-8-10-2-1-3-11(15-10)14-9-4-6-13-7-5-9/h1-3,9,13H,4-7H2,(H,14,15).
What are the key properties of 6-(piperidin-4-ylamino)pyridine-2-carbonitrile?
6-(piperidin-4-ylamino)pyridine-2-carbonitrile has a molecular weight of 202.26 g/mol, XLogP of 1.12, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(piperidin-4-ylamino)pyridine-2-carbonitrile is sourced from PubChem (CID 64589581), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).