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

C23H21N3O4 — CID 24879205

IUPAC6-naphthalen-1-yloxy-N-(3,4,5-trimethoxyphenyl)pyrazin-2-amine
SMILESCOc1cc(Nc2cncc(Oc3cccc4ccccc34)n2)cc(OC)c1OC
InChIInChI=1S/C23H21N3O4/c1-27-19-11-16(12-20(28-2)23(19)29-3)25-21-13-24-14-22(26-21)30-18-10-6-8-15-7-4-5-9-17(15)18/h4-14H,1-3H3,(H,25,26)
InChIKeyXHELPAXZVJVVIO-UHFFFAOYSA-N
MW403.44 g/mol
LogP5.19
Rot. Bonds7

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

6-naphthalen-1-yloxy-N-(3,4,5-trimethoxyphenyl)pyrazin-2-amine (PubChem CID 24879205) has the molecular formula C23H21N3O4 and a molecular weight of 403.44 g/mol. Its IUPAC name is 6-naphthalen-1-yloxy-N-(3,4,5-trimethoxyphenyl)pyrazin-2-amine.

Molecular Properties

Compound Name6-naphthalen-1-yloxy-N-(3,4,5-trimethoxyphenyl)pyrazin-2-amine
PubChem CID24879205
Molecular FormulaC23H21N3O4
Molecular Weight403.44 g/mol
Exact Mass403.15
IUPAC Name6-naphthalen-1-yloxy-N-(3,4,5-trimethoxyphenyl)pyrazin-2-amine
SMILESCOc1cc(Nc2cncc(Oc3cccc4ccccc34)n2)cc(OC)c1OC
InChIInChI=1S/C23H21N3O4/c1-27-19-11-16(12-20(28-2)23(19)29-3)25-21-13-24-14-22(26-21)30-18-10-6-8-15-7-4-5-9-17(15)18/h4-14H,1-3H3,(H,25,26)
InChIKeyXHELPAXZVJVVIO-UHFFFAOYSA-N
XLogP5.19
TPSA74.73 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds7
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500403.44
LogP ≤ 55.19
H-Bond Donors ≤ 51
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
N-[5-({6-[(3,4,5-trimethoxyphenyl)amino]pyrazin-2-yl}oxy)naphthalen-1-yl]acetamide
CID 24879265
N-{4-[6-(3,4,5-trimethoxyphenylamino)pyrazin-2-yloxy]naphthalen-1-yl}acetamide
CID 24879328
3-{6-[(3,4,5-Trimethoxyphenyl)amino]pyrazin-2-yl}phenol
CID 11595532
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
2-(3,4,5-Trimethoxyphenylamino)-6-(4-acetamidophenyl-oxy)-pyrazine
CID 24879264
6-(1H-indol-4-yloxy)-N-(3,4,5-trimethoxyphenyl)pyrazin-2-amine
CID 24879396
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
6-(Pyridin-3-yloxy)-N-(3,4,5-trimethoxyphenyl)pyrazin-2-amine
CID 24879206
6-(5,6,7,8-tetrahydronaphthalen-1-yloxy)-N-(3,4,5-trimethoxyphenyl)pyrazin-2-amine
CID 24879207

Frequently Asked Questions

What is the IUPAC name of 6-naphthalen-1-yloxy-N-(3,4,5-trimethoxyphenyl)pyrazin-2-amine?
The IUPAC name of 6-naphthalen-1-yloxy-N-(3,4,5-trimethoxyphenyl)pyrazin-2-amine (CID 24879205) is 6-naphthalen-1-yloxy-N-(3,4,5-trimethoxyphenyl)pyrazin-2-amine.
What is the SMILES notation for 6-naphthalen-1-yloxy-N-(3,4,5-trimethoxyphenyl)pyrazin-2-amine?
The canonical SMILES for 6-naphthalen-1-yloxy-N-(3,4,5-trimethoxyphenyl)pyrazin-2-amine is COc1cc(Nc2cncc(Oc3cccc4ccccc34)n2)cc(OC)c1OC.
What is the InChIKey of 6-naphthalen-1-yloxy-N-(3,4,5-trimethoxyphenyl)pyrazin-2-amine?
The InChIKey is XHELPAXZVJVVIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H21N3O4/c1-27-19-11-16(12-20(28-2)23(19)29-3)25-21-13-24-14-22(26-21)30-18-10-6-8-15-7-4-5-9-17(15)18/h4-14H,1-3H3,(H,25,26).
What are the key properties of 6-naphthalen-1-yloxy-N-(3,4,5-trimethoxyphenyl)pyrazin-2-amine?
6-naphthalen-1-yloxy-N-(3,4,5-trimethoxyphenyl)pyrazin-2-amine has a molecular weight of 403.44 g/mol, XLogP of 5.19, 7 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-naphthalen-1-yloxy-N-(3,4,5-trimethoxyphenyl)pyrazin-2-amine is sourced from PubChem (CID 24879205), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).