1-(8-chloro-[1,2,4]triazolo[1,5-a]pyridin-2-yl)ethanamine

C8H9ClN4 — CID 83870092

IUPAC1-(8-chloro-[1,2,4]triazolo[1,5-a]pyridin-2-yl)ethanamine
SMILESCC(N)c1nc2c(Cl)cccn2n1
InChIInChI=1S/C8H9ClN4/c1-5(10)7-11-8-6(9)3-2-4-13(8)12-7/h2-5H,10H2,1H3
InChIKeyRMQQCAYTRXQUCO-UHFFFAOYSA-N
MW196.64 g/mol
LogP1.40
Rot. Bonds1

About 1-(8-chloro-[1,2,4]triazolo[1,5-a]pyridin-2-yl)ethanamine

1-(8-chloro-[1,2,4]triazolo[1,5-a]pyridin-2-yl)ethanamine (PubChem CID 83870092) has the molecular formula C8H9ClN4 and a molecular weight of 196.64 g/mol. Its IUPAC name is 1-(8-chloro-[1,2,4]triazolo[1,5-a]pyridin-2-yl)ethanamine.

Molecular Properties

Compound Name1-(8-chloro-[1,2,4]triazolo[1,5-a]pyridin-2-yl)ethanamine
PubChem CID83870092
Molecular FormulaC8H9ClN4
Molecular Weight196.64 g/mol
Exact Mass196.05
IUPAC Name1-(8-chloro-[1,2,4]triazolo[1,5-a]pyridin-2-yl)ethanamine
SMILESCC(N)c1nc2c(Cl)cccn2n1
InChIInChI=1S/C8H9ClN4/c1-5(10)7-11-8-6(9)3-2-4-13(8)12-7/h2-5H,10H2,1H3
InChIKeyRMQQCAYTRXQUCO-UHFFFAOYSA-N
XLogP1.40
TPSA56.21 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.64
LogP ≤ 51.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

8-chloro-2-iodo-[1,2,4]triazolo[1,5-a]pyridine
CID 142607838
2-(azepan-1-ylmethyl)-8-chloro-[1,2,4]triazolo[1,5-a]pyridine
CID 117257999
2-propan-2-yl-[1,2,4]triazolo[1,5-a]pyridine-8-carboxamide
CID 173339684
8-chloro-2-pyridin-4-yl-[1,2,4]triazolo[1,5-a]pyridine
CID 117137892
2-propan-2-yl-[1,2,4]triazolo[1,5-a]pyridine-8-carbaldehyde
CID 83829233
8-chloro-2-(phenoxymethyl)-[1,2,4]triazolo[1,5-a]pyridine
CID 117258014
8-chloro-2-(piperazin-1-ylmethyl)-[1,2,4]triazolo[1,5-a]pyridine
CID 117258003
8-chloro-2-[(1-methylpiperidin-2-yl)methyl]-[1,2,4]triazolo[1,5-a]pyridine
CID 117136871
8-chloro-2-(2-methylpropyl)imidazo[1,2-a]pyridin-3-amine
CID 103095037
8-chloro-2-(oxan-4-ylmethyl)-[1,2,4]triazolo[1,5-a]pyridine
CID 117136192
(1S)-1-(11,12-dimethyl-10-oxa-3,5,6,8-tetrazatricyclo[7.3.0.02,6]dodeca-1(9),2,4,7,11-pentaen-4-yl)ethanamine
CID 73440609
1-(2-ethyl-[1,2,4]triazolo[1,5-a]pyridin-8-yl)propan-2-amine
CID 83866103

Frequently Asked Questions

What is the IUPAC name of 1-(8-chloro-[1,2,4]triazolo[1,5-a]pyridin-2-yl)ethanamine?
The IUPAC name of 1-(8-chloro-[1,2,4]triazolo[1,5-a]pyridin-2-yl)ethanamine (CID 83870092) is 1-(8-chloro-[1,2,4]triazolo[1,5-a]pyridin-2-yl)ethanamine.
What is the SMILES notation for 1-(8-chloro-[1,2,4]triazolo[1,5-a]pyridin-2-yl)ethanamine?
The canonical SMILES for 1-(8-chloro-[1,2,4]triazolo[1,5-a]pyridin-2-yl)ethanamine is CC(N)c1nc2c(Cl)cccn2n1.
What is the InChIKey of 1-(8-chloro-[1,2,4]triazolo[1,5-a]pyridin-2-yl)ethanamine?
The InChIKey is RMQQCAYTRXQUCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9ClN4/c1-5(10)7-11-8-6(9)3-2-4-13(8)12-7/h2-5H,10H2,1H3.
What are the key properties of 1-(8-chloro-[1,2,4]triazolo[1,5-a]pyridin-2-yl)ethanamine?
1-(8-chloro-[1,2,4]triazolo[1,5-a]pyridin-2-yl)ethanamine has a molecular weight of 196.64 g/mol, XLogP of 1.40, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(8-chloro-[1,2,4]triazolo[1,5-a]pyridin-2-yl)ethanamine is sourced from PubChem (CID 83870092), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).