2-(1,3-benzodioxol-5-yl)-8-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-amine

C14H12N4O2 — CID 83964966

IUPAC2-(1,3-benzodioxol-5-yl)-8-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-amine
SMILESCc1cc(N)cn2nc(-c3ccc4c(c3)OCO4)nc12
InChIInChI=1S/C14H12N4O2/c1-8-4-10(15)6-18-14(8)16-13(17-18)9-2-3-11-12(5-9)20-7-19-11/h2-6H,7,15H2,1H3
InChIKeyOAWHJMBHSQUDOK-UHFFFAOYSA-N
MW268.28 g/mol
LogP2.02
Rot. Bonds1

About 2-(1,3-benzodioxol-5-yl)-8-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-amine

2-(1,3-benzodioxol-5-yl)-8-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-amine (PubChem CID 83964966) has the molecular formula C14H12N4O2 and a molecular weight of 268.28 g/mol. Its IUPAC name is 2-(1,3-benzodioxol-5-yl)-8-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-amine.

Molecular Properties

Compound Name2-(1,3-benzodioxol-5-yl)-8-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-amine
PubChem CID83964966
Molecular FormulaC14H12N4O2
Molecular Weight268.28 g/mol
Exact Mass268.10
IUPAC Name2-(1,3-benzodioxol-5-yl)-8-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-amine
SMILESCc1cc(N)cn2nc(-c3ccc4c(c3)OCO4)nc12
InChIInChI=1S/C14H12N4O2/c1-8-4-10(15)6-18-14(8)16-13(17-18)9-2-3-11-12(5-9)20-7-19-11/h2-6H,7,15H2,1H3
InChIKeyOAWHJMBHSQUDOK-UHFFFAOYSA-N
XLogP2.02
TPSA74.67 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.28
LogP ≤ 52.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

2-(2-fluorophenyl)-8-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-amine
CID 83964861
4-(2,3-dihydro-1,4-benzodioxin-6-yl)-10-methyl-3,5,6,8,10,11-hexazatricyclo[7.3.0.02,6]dodeca-1(9),2,4,7,11-pentaene
CID 4777073
3-(1,3-benzodioxol-5-yl)-1-methylpyrazol-5-amine
CID 43158870
2-(1,3-benzodioxol-5-yl)-4-chloro-6-methylpyrimidine
CID 43557789
4-(1,3-benzodioxol-5-yl)benzene-1,2-diamine
CID 22478061
2-(1,3-benzodioxol-5-yl)-6-methylimidazo[1,2-a]pyridin-3-amine
CID 63618611
5-(1,3-benzodioxol-5-yl)-3-methyl-1,2-oxazol-4-amine
CID 82472014
2-(1,3-benzodioxol-5-yl)-1-hydroxy-4,5-dimethylimidazole
CID 134119166
2-(2,3-dihydro-1,4-benzodioxin-6-yl)-6-methylpyrimidin-4-amine
CID 62203853
4-[3-(1,3-benzodioxol-5-yl)-1H-pyrazol-5-yl]-3,5,6,8,10,11-hexazatricyclo[7.3.0.02,6]dodeca-1(9),2,4,7,11-pentaene
CID 135836237
[3-(1,3-benzodioxol-5-yl)-2-methylimidazo[2,1-b][1,3]thiazol-6-yl]methanol
CID 82062099
2-(1,3-benzodioxol-5-yl)-6-chloroimidazo[1,2-b]pyridazine
CID 15749997

Frequently Asked Questions

What is the IUPAC name of 2-(1,3-benzodioxol-5-yl)-8-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-amine?
The IUPAC name of 2-(1,3-benzodioxol-5-yl)-8-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-amine (CID 83964966) is 2-(1,3-benzodioxol-5-yl)-8-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-amine.
What is the SMILES notation for 2-(1,3-benzodioxol-5-yl)-8-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-amine?
The canonical SMILES for 2-(1,3-benzodioxol-5-yl)-8-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-amine is Cc1cc(N)cn2nc(-c3ccc4c(c3)OCO4)nc12.
What is the InChIKey of 2-(1,3-benzodioxol-5-yl)-8-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-amine?
The InChIKey is OAWHJMBHSQUDOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12N4O2/c1-8-4-10(15)6-18-14(8)16-13(17-18)9-2-3-11-12(5-9)20-7-19-11/h2-6H,7,15H2,1H3.
What are the key properties of 2-(1,3-benzodioxol-5-yl)-8-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-amine?
2-(1,3-benzodioxol-5-yl)-8-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-amine has a molecular weight of 268.28 g/mol, XLogP of 2.02, 1 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1,3-benzodioxol-5-yl)-8-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-amine is sourced from PubChem (CID 83964966), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).