2-chloro-4-(1H-indol-3-yl)imidazo[2,1-f][1,2,4]triazine

C13H8ClN5 — CID 163210234

IUPAC2-chloro-4-(1H-indol-3-yl)imidazo[2,1-f][1,2,4]triazine
SMILESClc1nc(-c2c[nH]c3ccccc23)c2nccn2n1
InChIInChI=1S/C13H8ClN5/c14-13-17-11(12-15-5-6-19(12)18-13)9-7-16-10-4-2-1-3-8(9)10/h1-7,16H
InChIKeyZHQCONOGSOXGBE-UHFFFAOYSA-N
MW269.70 g/mol
LogP2.93
Rot. Bonds1

About 2-chloro-4-(1H-indol-3-yl)imidazo[2,1-f][1,2,4]triazine

2-chloro-4-(1H-indol-3-yl)imidazo[2,1-f][1,2,4]triazine (PubChem CID 163210234) has the molecular formula C13H8ClN5 and a molecular weight of 269.70 g/mol. Its IUPAC name is 2-chloro-4-(1H-indol-3-yl)imidazo[2,1-f][1,2,4]triazine.

Molecular Properties

Compound Name2-chloro-4-(1H-indol-3-yl)imidazo[2,1-f][1,2,4]triazine
PubChem CID163210234
Molecular FormulaC13H8ClN5
Molecular Weight269.70 g/mol
Exact Mass269.05
IUPAC Name2-chloro-4-(1H-indol-3-yl)imidazo[2,1-f][1,2,4]triazine
SMILESClc1nc(-c2c[nH]c3ccccc23)c2nccn2n1
InChIInChI=1S/C13H8ClN5/c14-13-17-11(12-15-5-6-19(12)18-13)9-7-16-10-4-2-1-3-8(9)10/h1-7,16H
InChIKeyZHQCONOGSOXGBE-UHFFFAOYSA-N
XLogP2.93
TPSA58.87 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.70
LogP ≤ 52.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

8-(1H-indol-3-yl)-N-piperidin-3-ylimidazo[1,2-b]pyridazin-6-amine
CID 175697301
2-(1H-indol-3-yl)-[1,2,4]triazolo[1,5-a]pyridine
CID 175946267
tert-butyl (3R)-3-[[4-(1H-indol-3-yl)imidazo[2,1-f][1,2,4]triazin-2-yl]amino]piperidine-1-carboxylate
CID 163210225
N-(1-azabicyclo[2.2.1]heptan-3-yl)-5-chloro-6-(1H-indol-3-yl)imidazo[1,2-a]pyrazin-8-amine
CID 166884968
4-chloro-6-(1H-indol-3-yl)pyrimidin-5-amine
CID 87800834
(3S)-N-[5-chloro-6-(1H-indol-3-yl)imidazo[1,2-a]pyrazin-8-yl]-1,2,3,4-tetrahydroquinolin-3-amine
CID 162383267
4-(1H-indol-3-yl)-1,3-oxazole
CID 45276627
6-(1H-indol-3-yl)-1,3,5-triazine-2,4-diamine
CID 14358165
4-(3,4-dichlorophenyl)-2-(1H-indol-3-yl)pyrimido[1,2-b]indazole-3-carbonitrile
CID 137254118
3-[1-methyl-5-(2-methylphenyl)-1,2,4-triazol-3-yl]-1H-indole;hydrochloride
CID 163988747
3-pyridin-4-yl-1H-indole
CID 159430533
3-[4-(1H-indol-3-yl)phenyl]-1H-indole
CID 175007681

Frequently Asked Questions

What is the IUPAC name of 2-chloro-4-(1H-indol-3-yl)imidazo[2,1-f][1,2,4]triazine?
The IUPAC name of 2-chloro-4-(1H-indol-3-yl)imidazo[2,1-f][1,2,4]triazine (CID 163210234) is 2-chloro-4-(1H-indol-3-yl)imidazo[2,1-f][1,2,4]triazine.
What is the SMILES notation for 2-chloro-4-(1H-indol-3-yl)imidazo[2,1-f][1,2,4]triazine?
The canonical SMILES for 2-chloro-4-(1H-indol-3-yl)imidazo[2,1-f][1,2,4]triazine is Clc1nc(-c2c[nH]c3ccccc23)c2nccn2n1.
What is the InChIKey of 2-chloro-4-(1H-indol-3-yl)imidazo[2,1-f][1,2,4]triazine?
The InChIKey is ZHQCONOGSOXGBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H8ClN5/c14-13-17-11(12-15-5-6-19(12)18-13)9-7-16-10-4-2-1-3-8(9)10/h1-7,16H.
What are the key properties of 2-chloro-4-(1H-indol-3-yl)imidazo[2,1-f][1,2,4]triazine?
2-chloro-4-(1H-indol-3-yl)imidazo[2,1-f][1,2,4]triazine has a molecular weight of 269.70 g/mol, XLogP of 2.93, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-4-(1H-indol-3-yl)imidazo[2,1-f][1,2,4]triazine is sourced from PubChem (CID 163210234), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).