2-(4-amino-6-piperidin-1-yl-1,3,5-triazin-2-yl)acetonitrile

C10H14N6 — CID 612767

IUPAC2-(4-amino-6-piperidin-1-yl-1,3,5-triazin-2-yl)acetonitrile
SMILESN#CCc1nc(N)nc(N2CCCCC2)n1
InChIInChI=1S/C10H14N6/c11-5-4-8-13-9(12)15-10(14-8)16-6-2-1-3-7-16/h1-4,6-7H2,(H2,12,13,14,15)
InChIKeyUZNUMNPZMUFXHR-UHFFFAOYSA-N
MW218.26 g/mol
LogP0.51
Rot. Bonds2

About 2-(4-amino-6-piperidin-1-yl-1,3,5-triazin-2-yl)acetonitrile

2-(4-amino-6-piperidin-1-yl-1,3,5-triazin-2-yl)acetonitrile (PubChem CID 612767) has the molecular formula C10H14N6 and a molecular weight of 218.26 g/mol. Its IUPAC name is 2-(4-amino-6-piperidin-1-yl-1,3,5-triazin-2-yl)acetonitrile.

Molecular Properties

Compound Name2-(4-amino-6-piperidin-1-yl-1,3,5-triazin-2-yl)acetonitrile
PubChem CID612767
Molecular FormulaC10H14N6
Molecular Weight218.26 g/mol
Exact Mass218.13
IUPAC Name2-(4-amino-6-piperidin-1-yl-1,3,5-triazin-2-yl)acetonitrile
SMILESN#CCc1nc(N)nc(N2CCCCC2)n1
InChIInChI=1S/C10H14N6/c11-5-4-8-13-9(12)15-10(14-8)16-6-2-1-3-7-16/h1-4,6-7H2,(H2,12,13,14,15)
InChIKeyUZNUMNPZMUFXHR-UHFFFAOYSA-N
XLogP0.51
TPSA91.72 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.26
LogP ≤ 50.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-(4-amino-6-piperidin-1-yl-1,3,5-triazin-2-yl)acetonitrile?
The IUPAC name of 2-(4-amino-6-piperidin-1-yl-1,3,5-triazin-2-yl)acetonitrile (CID 612767) is 2-(4-amino-6-piperidin-1-yl-1,3,5-triazin-2-yl)acetonitrile.
What is the SMILES notation for 2-(4-amino-6-piperidin-1-yl-1,3,5-triazin-2-yl)acetonitrile?
The canonical SMILES for 2-(4-amino-6-piperidin-1-yl-1,3,5-triazin-2-yl)acetonitrile is N#CCc1nc(N)nc(N2CCCCC2)n1.
What is the InChIKey of 2-(4-amino-6-piperidin-1-yl-1,3,5-triazin-2-yl)acetonitrile?
The InChIKey is UZNUMNPZMUFXHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N6/c11-5-4-8-13-9(12)15-10(14-8)16-6-2-1-3-7-16/h1-4,6-7H2,(H2,12,13,14,15).
What are the key properties of 2-(4-amino-6-piperidin-1-yl-1,3,5-triazin-2-yl)acetonitrile?
2-(4-amino-6-piperidin-1-yl-1,3,5-triazin-2-yl)acetonitrile has a molecular weight of 218.26 g/mol, XLogP of 0.51, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-amino-6-piperidin-1-yl-1,3,5-triazin-2-yl)acetonitrile is sourced from PubChem (CID 612767), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).