6-(1H-indol-4-yloxy)-N-(3,4,5-trimethoxyphenyl)pyrazin-2-amine

C21H20N4O4 — CID 24879396

IUPAC6-(1H-indol-4-yloxy)-N-(3,4,5-trimethoxyphenyl)pyrazin-2-amine
SMILESCOc1cc(Nc2cncc(Oc3cccc4[nH]ccc34)n2)cc(OC)c1OC
InChIInChI=1S/C21H20N4O4/c1-26-17-9-13(10-18(27-2)21(17)28-3)24-19-11-22-12-20(25-19)29-16-6-4-5-15-14(16)7-8-23-15/h4-12,23H,1-3H3,(H,24,25)
InChIKeyUEFRPRBURSHLSA-UHFFFAOYSA-N
MW392.42 g/mol
LogP4.52
Rot. Bonds7

About 6-(1H-indol-4-yloxy)-N-(3,4,5-trimethoxyphenyl)pyrazin-2-amine

6-(1H-indol-4-yloxy)-N-(3,4,5-trimethoxyphenyl)pyrazin-2-amine (PubChem CID 24879396) has the molecular formula C21H20N4O4 and a molecular weight of 392.42 g/mol. Its IUPAC name is 6-(1H-indol-4-yloxy)-N-(3,4,5-trimethoxyphenyl)pyrazin-2-amine.

Molecular Properties

Compound Name6-(1H-indol-4-yloxy)-N-(3,4,5-trimethoxyphenyl)pyrazin-2-amine
PubChem CID24879396
Molecular FormulaC21H20N4O4
Molecular Weight392.42 g/mol
Exact Mass392.15
IUPAC Name6-(1H-indol-4-yloxy)-N-(3,4,5-trimethoxyphenyl)pyrazin-2-amine
SMILESCOc1cc(Nc2cncc(Oc3cccc4[nH]ccc34)n2)cc(OC)c1OC
InChIInChI=1S/C21H20N4O4/c1-26-17-9-13(10-18(27-2)21(17)28-3)24-19-11-22-12-20(25-19)29-16-6-4-5-15-14(16)7-8-23-15/h4-12,23H,1-3H3,(H,24,25)
InChIKeyUEFRPRBURSHLSA-UHFFFAOYSA-N
XLogP4.52
TPSA90.52 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500392.42
LogP ≤ 54.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Related Compounds

4-[(5,6-Dimethyl-2,2'-Bipyridin-3-Yl)oxy]-N-(3,4,5-Trimethoxyphenyl)pyridin-2-Amine
CID 44201376
7-(1H-indol-2-yl)-5-methyl-N-(3,4,5-trimethoxyphenyl)imidazo[5,1-f][1,2,4]triazin-2-amine
CID 135545443
4-(6-Methyl-2-pyridin-2-yl-pyridin-3-yl)oxy-N-(3,4,5-trimethoxy-phenyl)pyridin-2-amine
CID 44521014
6-(naphthalen-1-yloxy)-N-(3,4,5-trimethoxyphenyl)pyrazin-2-amine
CID 24879205
6-(quinolin-5-yloxy)-N-(3,4,5-trimethoxyphenyl)pyrazin-2-amine
CID 24879208
6-(isoquinolin-5-yloxy)-N-(3,4,5-trimethoxyphenyl)pyrazin-2-amine
CID 24879209
6-(quinolin-4-yloxy)-N-(3,4,5-trimethoxyphenyl)pyrazin-2-amine
CID 24879463
6-(2-phenylphenoxy)-N-(3,4,5-trimethoxyphenyl)pyrazin-2-amine
CID 24879527
4-(quinolin-3-yloxy)-N-(3,4,5-trimethoxyphenyl)pyrimidin-2-amine
CID 54585373
Nat2-IN-1
CID 11515868
[4-(1H-Pyrrolo[2,3-b]pyridin-3-yl)-pyrimidin-2-yl]-(3,4,5-trimethoxy-phenyl)-amine
CID 24860829
1-(1H-indol-5-yl)-6-(3,4,5-trimethoxyphenyl)-1H-imidazo[4,5-b]pyrazin-2(3H)-one
CID 46234666

Frequently Asked Questions

What is the IUPAC name of 6-(1H-indol-4-yloxy)-N-(3,4,5-trimethoxyphenyl)pyrazin-2-amine?
The IUPAC name of 6-(1H-indol-4-yloxy)-N-(3,4,5-trimethoxyphenyl)pyrazin-2-amine (CID 24879396) is 6-(1H-indol-4-yloxy)-N-(3,4,5-trimethoxyphenyl)pyrazin-2-amine.
What is the SMILES notation for 6-(1H-indol-4-yloxy)-N-(3,4,5-trimethoxyphenyl)pyrazin-2-amine?
The canonical SMILES for 6-(1H-indol-4-yloxy)-N-(3,4,5-trimethoxyphenyl)pyrazin-2-amine is COc1cc(Nc2cncc(Oc3cccc4[nH]ccc34)n2)cc(OC)c1OC.
What is the InChIKey of 6-(1H-indol-4-yloxy)-N-(3,4,5-trimethoxyphenyl)pyrazin-2-amine?
The InChIKey is UEFRPRBURSHLSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H20N4O4/c1-26-17-9-13(10-18(27-2)21(17)28-3)24-19-11-22-12-20(25-19)29-16-6-4-5-15-14(16)7-8-23-15/h4-12,23H,1-3H3,(H,24,25).
What are the key properties of 6-(1H-indol-4-yloxy)-N-(3,4,5-trimethoxyphenyl)pyrazin-2-amine?
6-(1H-indol-4-yloxy)-N-(3,4,5-trimethoxyphenyl)pyrazin-2-amine has a molecular weight of 392.42 g/mol, XLogP of 4.52, 7 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(1H-indol-4-yloxy)-N-(3,4,5-trimethoxyphenyl)pyrazin-2-amine is sourced from PubChem (CID 24879396), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).