N-phenyl-5-piperidin-4-yl-[1,2,4]triazolo[1,5-a]pyridin-2-amine

C17H19N5 — CID 59276461

IUPACN-phenyl-5-piperidin-4-yl-[1,2,4]triazolo[1,5-a]pyridin-2-amine
SMILESc1ccc(Nc2nc3cccc(C4CCNCC4)n3n2)cc1
InChIInChI=1S/C17H19N5/c1-2-5-14(6-3-1)19-17-20-16-8-4-7-15(22(16)21-17)13-9-11-18-12-10-13/h1-8,13,18H,9-12H2,(H,19,21)
InChIKeyHQHXRRZSHNZQSP-UHFFFAOYSA-N
MW293.37 g/mol
LogP2.94
Rot. Bonds3

About N-phenyl-5-piperidin-4-yl-[1,2,4]triazolo[1,5-a]pyridin-2-amine

N-phenyl-5-piperidin-4-yl-[1,2,4]triazolo[1,5-a]pyridin-2-amine (PubChem CID 59276461) has the molecular formula C17H19N5 and a molecular weight of 293.37 g/mol. Its IUPAC name is N-phenyl-5-piperidin-4-yl-[1,2,4]triazolo[1,5-a]pyridin-2-amine.

Molecular Properties

Compound NameN-phenyl-5-piperidin-4-yl-[1,2,4]triazolo[1,5-a]pyridin-2-amine
PubChem CID59276461
Molecular FormulaC17H19N5
Molecular Weight293.37 g/mol
Exact Mass293.16
IUPAC NameN-phenyl-5-piperidin-4-yl-[1,2,4]triazolo[1,5-a]pyridin-2-amine
SMILESc1ccc(Nc2nc3cccc(C4CCNCC4)n3n2)cc1
InChIInChI=1S/C17H19N5/c1-2-5-14(6-3-1)19-17-20-16-8-4-7-15(22(16)21-17)13-9-11-18-12-10-13/h1-8,13,18H,9-12H2,(H,19,21)
InChIKeyHQHXRRZSHNZQSP-UHFFFAOYSA-N
XLogP2.94
TPSA54.25 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.37
LogP ≤ 52.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-phenyl-5-piperidin-4-yl-[1,2,4]triazolo[1,5-a]pyridin-2-amine?
The IUPAC name of N-phenyl-5-piperidin-4-yl-[1,2,4]triazolo[1,5-a]pyridin-2-amine (CID 59276461) is N-phenyl-5-piperidin-4-yl-[1,2,4]triazolo[1,5-a]pyridin-2-amine.
What is the SMILES notation for N-phenyl-5-piperidin-4-yl-[1,2,4]triazolo[1,5-a]pyridin-2-amine?
The canonical SMILES for N-phenyl-5-piperidin-4-yl-[1,2,4]triazolo[1,5-a]pyridin-2-amine is c1ccc(Nc2nc3cccc(C4CCNCC4)n3n2)cc1.
What is the InChIKey of N-phenyl-5-piperidin-4-yl-[1,2,4]triazolo[1,5-a]pyridin-2-amine?
The InChIKey is HQHXRRZSHNZQSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N5/c1-2-5-14(6-3-1)19-17-20-16-8-4-7-15(22(16)21-17)13-9-11-18-12-10-13/h1-8,13,18H,9-12H2,(H,19,21).
What are the key properties of N-phenyl-5-piperidin-4-yl-[1,2,4]triazolo[1,5-a]pyridin-2-amine?
N-phenyl-5-piperidin-4-yl-[1,2,4]triazolo[1,5-a]pyridin-2-amine has a molecular weight of 293.37 g/mol, XLogP of 2.94, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-phenyl-5-piperidin-4-yl-[1,2,4]triazolo[1,5-a]pyridin-2-amine is sourced from PubChem (CID 59276461), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).