N,6-dimethyl-N-(piperidin-3-ylmethyl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine

C14H21N5 — CID 106642913

IUPACN,6-dimethyl-N-(piperidin-3-ylmethyl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine
SMILESCc1ccc2nc(N(C)CC3CCCNC3)nn2c1
InChIInChI=1S/C14H21N5/c1-11-5-6-13-16-14(17-19(13)9-11)18(2)10-12-4-3-7-15-8-12/h5-6,9,12,15H,3-4,7-8,10H2,1-2H3
InChIKeyQXGCUOYCQYQBKZ-UHFFFAOYSA-N
MW259.36 g/mol
LogP1.47
Rot. Bonds3

About N,6-dimethyl-N-(piperidin-3-ylmethyl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine

N,6-dimethyl-N-(piperidin-3-ylmethyl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine (PubChem CID 106642913) has the molecular formula C14H21N5 and a molecular weight of 259.36 g/mol. Its IUPAC name is N,6-dimethyl-N-(piperidin-3-ylmethyl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine.

Molecular Properties

Compound NameN,6-dimethyl-N-(piperidin-3-ylmethyl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine
PubChem CID106642913
Molecular FormulaC14H21N5
Molecular Weight259.36 g/mol
Exact Mass259.18
IUPAC NameN,6-dimethyl-N-(piperidin-3-ylmethyl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine
SMILESCc1ccc2nc(N(C)CC3CCCNC3)nn2c1
InChIInChI=1S/C14H21N5/c1-11-5-6-13-16-14(17-19(13)9-11)18(2)10-12-4-3-7-15-8-12/h5-6,9,12,15H,3-4,7-8,10H2,1-2H3
InChIKeyQXGCUOYCQYQBKZ-UHFFFAOYSA-N
XLogP1.47
TPSA45.46 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.36
LogP ≤ 51.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N,6-dimethyl-N-(piperidin-3-ylmethyl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine?
The IUPAC name of N,6-dimethyl-N-(piperidin-3-ylmethyl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine (CID 106642913) is N,6-dimethyl-N-(piperidin-3-ylmethyl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine.
What is the SMILES notation for N,6-dimethyl-N-(piperidin-3-ylmethyl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine?
The canonical SMILES for N,6-dimethyl-N-(piperidin-3-ylmethyl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine is Cc1ccc2nc(N(C)CC3CCCNC3)nn2c1.
What is the InChIKey of N,6-dimethyl-N-(piperidin-3-ylmethyl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine?
The InChIKey is QXGCUOYCQYQBKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N5/c1-11-5-6-13-16-14(17-19(13)9-11)18(2)10-12-4-3-7-15-8-12/h5-6,9,12,15H,3-4,7-8,10H2,1-2H3.
What are the key properties of N,6-dimethyl-N-(piperidin-3-ylmethyl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine?
N,6-dimethyl-N-(piperidin-3-ylmethyl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine has a molecular weight of 259.36 g/mol, XLogP of 1.47, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,6-dimethyl-N-(piperidin-3-ylmethyl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine is sourced from PubChem (CID 106642913), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).