8-(1H-indol-6-yl)-N-(1-pyridin-3-ylethyl)quinoxalin-6-amine

C23H19N5 — CID 134540243

IUPAC8-(1H-indol-6-yl)-N-(1-pyridin-3-ylethyl)quinoxalin-6-amine
SMILESCC(Nc1cc(-c2ccc3cc[nH]c3c2)c2nccnc2c1)c1cccnc1
InChIInChI=1S/C23H19N5/c1-15(18-3-2-7-24-14-18)28-19-12-20(23-22(13-19)26-9-10-27-23)17-5-4-16-6-8-25-21(16)11-17/h2-15,25,28H,1H3
InChIKeyIJZMFXUOFNFLBN-UHFFFAOYSA-N
MW365.44 g/mol
LogP5.35
Rot. Bonds4

About 8-(1H-indol-6-yl)-N-(1-pyridin-3-ylethyl)quinoxalin-6-amine

8-(1H-indol-6-yl)-N-(1-pyridin-3-ylethyl)quinoxalin-6-amine (PubChem CID 134540243) has the molecular formula C23H19N5 and a molecular weight of 365.44 g/mol. Its IUPAC name is 8-(1H-indol-6-yl)-N-(1-pyridin-3-ylethyl)quinoxalin-6-amine.

Molecular Properties

Compound Name8-(1H-indol-6-yl)-N-(1-pyridin-3-ylethyl)quinoxalin-6-amine
PubChem CID134540243
Molecular FormulaC23H19N5
Molecular Weight365.44 g/mol
Exact Mass365.16
IUPAC Name8-(1H-indol-6-yl)-N-(1-pyridin-3-ylethyl)quinoxalin-6-amine
SMILESCC(Nc1cc(-c2ccc3cc[nH]c3c2)c2nccnc2c1)c1cccnc1
InChIInChI=1S/C23H19N5/c1-15(18-3-2-7-24-14-18)28-19-12-20(23-22(13-19)26-9-10-27-23)17-5-4-16-6-8-25-21(16)11-17/h2-15,25,28H,1H3
InChIKeyIJZMFXUOFNFLBN-UHFFFAOYSA-N
XLogP5.35
TPSA66.49 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500365.44
LogP ≤ 55.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

8-(1-methylindol-6-yl)-N-(1-pyridin-3-ylethyl)quinoxalin-6-amine
CID 122689144
6-[7-(1-pyridin-3-ylethylamino)quinoxalin-5-yl]chromen-4-one
CID 122689019
8-[3-(3-aminoazetidin-1-yl)phenyl]-N-(1-pyridin-3-ylethyl)quinoxalin-6-amine;ethane
CID 145185350
N-(1-pyridin-3-ylpropyl)-8-quinolin-6-ylquinoxalin-6-amine
CID 145185335
8-(1-methylindol-6-yl)-N-(1-pyridin-4-ylethyl)quinoxalin-6-amine
CID 122689036
8-(1-methylindol-6-yl)-N-(1-pyrazin-2-ylethyl)quinoxalin-6-amine
CID 122689287
N-[(R)-(6-methylidene-1H-pyridazin-3-yl)-pyridin-3-ylmethyl]-8-(1-methylindol-6-yl)quinoxalin-6-amine
CID 134509466
N-[(1R)-1-(3-ethoxyphenyl)ethyl]-8-(1-methylindol-6-yl)quinoxalin-6-amine
CID 122689360
ethane;4-[7-[[piperidin-4-yl(pyridin-3-yl)methyl]amino]quinoxalin-5-yl]benzenethiol
CID 145185016
N-[cyclohexyl(pyridin-3-yl)methyl]-8-(1-methylindol-6-yl)quinoxalin-6-amine;N,N-diethyl-2-[4-[[[8-(1-methylindol-6-yl)quinoxalin-6-yl]amino]-pyridin-3-ylmethyl]piperidin-1-yl]acetamide
CID 158436803
N-[(S)-(1-methylpyrazol-4-yl)-pyridin-3-ylmethyl]-8-(1-methylpyrrolo[3,2-b]pyridin-6-yl)quinoxalin-6-amine
CID 134509543
N-[(6-methoxypyridazin-3-yl)-pyridin-3-ylmethyl]-8-(1-methyl-2,3-dihydroindol-6-yl)quinoxalin-6-amine
CID 134509542

Frequently Asked Questions

What is the IUPAC name of 8-(1H-indol-6-yl)-N-(1-pyridin-3-ylethyl)quinoxalin-6-amine?
The IUPAC name of 8-(1H-indol-6-yl)-N-(1-pyridin-3-ylethyl)quinoxalin-6-amine (CID 134540243) is 8-(1H-indol-6-yl)-N-(1-pyridin-3-ylethyl)quinoxalin-6-amine.
What is the SMILES notation for 8-(1H-indol-6-yl)-N-(1-pyridin-3-ylethyl)quinoxalin-6-amine?
The canonical SMILES for 8-(1H-indol-6-yl)-N-(1-pyridin-3-ylethyl)quinoxalin-6-amine is CC(Nc1cc(-c2ccc3cc[nH]c3c2)c2nccnc2c1)c1cccnc1.
What is the InChIKey of 8-(1H-indol-6-yl)-N-(1-pyridin-3-ylethyl)quinoxalin-6-amine?
The InChIKey is IJZMFXUOFNFLBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H19N5/c1-15(18-3-2-7-24-14-18)28-19-12-20(23-22(13-19)26-9-10-27-23)17-5-4-16-6-8-25-21(16)11-17/h2-15,25,28H,1H3.
What are the key properties of 8-(1H-indol-6-yl)-N-(1-pyridin-3-ylethyl)quinoxalin-6-amine?
8-(1H-indol-6-yl)-N-(1-pyridin-3-ylethyl)quinoxalin-6-amine has a molecular weight of 365.44 g/mol, XLogP of 5.35, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(1H-indol-6-yl)-N-(1-pyridin-3-ylethyl)quinoxalin-6-amine is sourced from PubChem (CID 134540243), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).