1-(3-chloro-[1,2,4]triazolo[4,3-a]pyridin-8-yl)propan-2-amine

C9H11ClN4 — CID 83870134

IUPAC1-(3-chloro-[1,2,4]triazolo[4,3-a]pyridin-8-yl)propan-2-amine
SMILESCC(N)Cc1cccn2c(Cl)nnc12
InChIInChI=1S/C9H11ClN4/c1-6(11)5-7-3-2-4-14-8(7)12-13-9(14)10/h2-4,6H,5,11H2,1H3
InChIKeyWTBDNXSPXRSQDE-UHFFFAOYSA-N
MW210.67 g/mol
LogP1.27
Rot. Bonds2

About 1-(3-chloro-[1,2,4]triazolo[4,3-a]pyridin-8-yl)propan-2-amine

1-(3-chloro-[1,2,4]triazolo[4,3-a]pyridin-8-yl)propan-2-amine (PubChem CID 83870134) has the molecular formula C9H11ClN4 and a molecular weight of 210.67 g/mol. Its IUPAC name is 1-(3-chloro-[1,2,4]triazolo[4,3-a]pyridin-8-yl)propan-2-amine.

Molecular Properties

Compound Name1-(3-chloro-[1,2,4]triazolo[4,3-a]pyridin-8-yl)propan-2-amine
PubChem CID83870134
Molecular FormulaC9H11ClN4
Molecular Weight210.67 g/mol
Exact Mass210.07
IUPAC Name1-(3-chloro-[1,2,4]triazolo[4,3-a]pyridin-8-yl)propan-2-amine
SMILESCC(N)Cc1cccn2c(Cl)nnc12
InChIInChI=1S/C9H11ClN4/c1-6(11)5-7-3-2-4-14-8(7)12-13-9(14)10/h2-4,6H,5,11H2,1H3
InChIKeyWTBDNXSPXRSQDE-UHFFFAOYSA-N
XLogP1.27
TPSA56.21 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.67
LogP ≤ 51.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-chloro-8-methyl-[1,2,4]triazolo[4,3-a]pyridine
CID 55267696
1-imidazo[1,2-a]pyridin-8-ylpropan-2-amine
CID 83865765
1-(2-ethyl-[1,2,4]triazolo[1,5-a]pyridin-8-yl)propan-2-amine
CID 83866103
3-(3-chloroimidazo[1,2-a]pyridin-8-yl)-2-methylpropanoic acid
CID 83842801
1-(2-cyclopropyl-[1,2,4]triazolo[1,5-a]pyridin-8-yl)propan-2-amine
CID 83866105
1-(3-chloro-[1,2,4]triazolo[4,3-a]pyridin-5-yl)propan-2-amine
CID 83870161
1-(2-methylpyrazolo[1,5-a]pyridin-4-yl)propan-2-amine
CID 83877276
1-(1-methylimidazo[1,5-a]pyridin-8-yl)propan-2-amine
CID 83864828
1-(2-cyclobutyl-[1,2,4]triazolo[1,5-a]pyridin-8-yl)propan-2-amine
CID 83866106
3-(2-aminopropyl)-8-chloroimidazo[1,5-a]pyridine-1-carboxylic acid
CID 117254982
1-(8-chloro-3-ethylimidazo[1,5-a]pyridin-1-yl)propan-2-amine
CID 83869364
8-(chloromethyl)-3-(ethoxymethyl)-[1,2,4]triazolo[4,3-a]pyridine
CID 53485966

Frequently Asked Questions

What is the IUPAC name of 1-(3-chloro-[1,2,4]triazolo[4,3-a]pyridin-8-yl)propan-2-amine?
The IUPAC name of 1-(3-chloro-[1,2,4]triazolo[4,3-a]pyridin-8-yl)propan-2-amine (CID 83870134) is 1-(3-chloro-[1,2,4]triazolo[4,3-a]pyridin-8-yl)propan-2-amine.
What is the SMILES notation for 1-(3-chloro-[1,2,4]triazolo[4,3-a]pyridin-8-yl)propan-2-amine?
The canonical SMILES for 1-(3-chloro-[1,2,4]triazolo[4,3-a]pyridin-8-yl)propan-2-amine is CC(N)Cc1cccn2c(Cl)nnc12.
What is the InChIKey of 1-(3-chloro-[1,2,4]triazolo[4,3-a]pyridin-8-yl)propan-2-amine?
The InChIKey is WTBDNXSPXRSQDE-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11ClN4/c1-6(11)5-7-3-2-4-14-8(7)12-13-9(14)10/h2-4,6H,5,11H2,1H3.
What are the key properties of 1-(3-chloro-[1,2,4]triazolo[4,3-a]pyridin-8-yl)propan-2-amine?
1-(3-chloro-[1,2,4]triazolo[4,3-a]pyridin-8-yl)propan-2-amine has a molecular weight of 210.67 g/mol, XLogP of 1.27, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-chloro-[1,2,4]triazolo[4,3-a]pyridin-8-yl)propan-2-amine is sourced from PubChem (CID 83870134), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).