N-(1,3-dimethylpiperidin-4-yl)-5-methyl-[1,2,4]triazolo[1,5-a]pyridin-2-amine

C14H21N5 — CID 114504814

IUPACN-(1,3-dimethylpiperidin-4-yl)-5-methyl-[1,2,4]triazolo[1,5-a]pyridin-2-amine
SMILESCc1cccc2nc(NC3CCN(C)CC3C)nn12
InChIInChI=1S/C14H21N5/c1-10-9-18(3)8-7-12(10)15-14-16-13-6-4-5-11(2)19(13)17-14/h4-6,10,12H,7-9H2,1-3H3,(H,15,17)
InChIKeyNDLGNBQCGFLWSM-UHFFFAOYSA-N
MW259.36 g/mol
LogP1.79
Rot. Bonds2

About N-(1,3-dimethylpiperidin-4-yl)-5-methyl-[1,2,4]triazolo[1,5-a]pyridin-2-amine

N-(1,3-dimethylpiperidin-4-yl)-5-methyl-[1,2,4]triazolo[1,5-a]pyridin-2-amine (PubChem CID 114504814) has the molecular formula C14H21N5 and a molecular weight of 259.36 g/mol. Its IUPAC name is N-(1,3-dimethylpiperidin-4-yl)-5-methyl-[1,2,4]triazolo[1,5-a]pyridin-2-amine.

Molecular Properties

Compound NameN-(1,3-dimethylpiperidin-4-yl)-5-methyl-[1,2,4]triazolo[1,5-a]pyridin-2-amine
PubChem CID114504814
Molecular FormulaC14H21N5
Molecular Weight259.36 g/mol
Exact Mass259.18
IUPAC NameN-(1,3-dimethylpiperidin-4-yl)-5-methyl-[1,2,4]triazolo[1,5-a]pyridin-2-amine
SMILESCc1cccc2nc(NC3CCN(C)CC3C)nn12
InChIInChI=1S/C14H21N5/c1-10-9-18(3)8-7-12(10)15-14-16-13-6-4-5-11(2)19(13)17-14/h4-6,10,12H,7-9H2,1-3H3,(H,15,17)
InChIKeyNDLGNBQCGFLWSM-UHFFFAOYSA-N
XLogP1.79
TPSA45.46 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.36
LogP ≤ 51.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(1,3-dimethylpiperidin-4-yl)-5-methyl-[1,2,4]triazolo[1,5-a]pyridin-2-amine?
The IUPAC name of N-(1,3-dimethylpiperidin-4-yl)-5-methyl-[1,2,4]triazolo[1,5-a]pyridin-2-amine (CID 114504814) is N-(1,3-dimethylpiperidin-4-yl)-5-methyl-[1,2,4]triazolo[1,5-a]pyridin-2-amine.
What is the SMILES notation for N-(1,3-dimethylpiperidin-4-yl)-5-methyl-[1,2,4]triazolo[1,5-a]pyridin-2-amine?
The canonical SMILES for N-(1,3-dimethylpiperidin-4-yl)-5-methyl-[1,2,4]triazolo[1,5-a]pyridin-2-amine is Cc1cccc2nc(NC3CCN(C)CC3C)nn12.
What is the InChIKey of N-(1,3-dimethylpiperidin-4-yl)-5-methyl-[1,2,4]triazolo[1,5-a]pyridin-2-amine?
The InChIKey is NDLGNBQCGFLWSM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N5/c1-10-9-18(3)8-7-12(10)15-14-16-13-6-4-5-11(2)19(13)17-14/h4-6,10,12H,7-9H2,1-3H3,(H,15,17).
What are the key properties of N-(1,3-dimethylpiperidin-4-yl)-5-methyl-[1,2,4]triazolo[1,5-a]pyridin-2-amine?
N-(1,3-dimethylpiperidin-4-yl)-5-methyl-[1,2,4]triazolo[1,5-a]pyridin-2-amine has a molecular weight of 259.36 g/mol, XLogP of 1.79, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1,3-dimethylpiperidin-4-yl)-5-methyl-[1,2,4]triazolo[1,5-a]pyridin-2-amine is sourced from PubChem (CID 114504814), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).