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

C18H18N4O4 — CID 24879206

IUPAC6-pyridin-3-yloxy-N-(3,4,5-trimethoxyphenyl)pyrazin-2-amine
SMILESCOc1cc(Nc2cncc(Oc3cccnc3)n2)cc(OC)c1OC
InChIInChI=1S/C18H18N4O4/c1-23-14-7-12(8-15(24-2)18(14)25-3)21-16-10-20-11-17(22-16)26-13-5-4-6-19-9-13/h4-11H,1-3H3,(H,21,22)
InChIKeyOVLFURDMHZJLCV-UHFFFAOYSA-N
MW354.37 g/mol
LogP3.43
Rot. Bonds7

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

6-pyridin-3-yloxy-N-(3,4,5-trimethoxyphenyl)pyrazin-2-amine (PubChem CID 24879206) has the molecular formula C18H18N4O4 and a molecular weight of 354.37 g/mol. Its IUPAC name is 6-pyridin-3-yloxy-N-(3,4,5-trimethoxyphenyl)pyrazin-2-amine.

Molecular Properties

Compound Name6-pyridin-3-yloxy-N-(3,4,5-trimethoxyphenyl)pyrazin-2-amine
PubChem CID24879206
Molecular FormulaC18H18N4O4
Molecular Weight354.37 g/mol
Exact Mass354.13
IUPAC Name6-pyridin-3-yloxy-N-(3,4,5-trimethoxyphenyl)pyrazin-2-amine
SMILESCOc1cc(Nc2cncc(Oc3cccnc3)n2)cc(OC)c1OC
InChIInChI=1S/C18H18N4O4/c1-23-14-7-12(8-15(24-2)18(14)25-3)21-16-10-20-11-17(22-16)26-13-5-4-6-19-9-13/h4-11H,1-3H3,(H,21,22)
InChIKeyOVLFURDMHZJLCV-UHFFFAOYSA-N
XLogP3.43
TPSA87.62 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.37
LogP ≤ 53.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

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Related Compounds

Tamatinib
CID 11213558
4-[(5,6-Dimethyl-2,2'-Bipyridin-3-Yl)oxy]-N-(3,4,5-Trimethoxyphenyl)pyridin-2-Amine
CID 44201376
4-Pyridin-3-yloxy-N-(3,4,5-trimethoxyphenyl)pyridin-2-amine
CID 44521016
4-[(6-methyl-3-pyridinyl)oxy]-N-(3,4,5-trimethoxyphenyl)pyridin-2-amine
CID 44521017
4-[(2-methyl-3-pyridinyl)oxy]-N-(3,4,5-trimethoxyphenyl)pyridin-2-amine
CID 44521018
N*1*-{5-[2-(3,4,5-Trimethoxy-phenylamino)-pyrimidin-4-yl]-pyridin-2-yl}-ethane-1,2-diamine
CID 15550318
4-(2-Anilinopyridin-3-Yl)-N-(3,4,5-Trimethoxyphenyl)-1,3,5-Triazin-2-Amine
CID 16040288
4-(6-Methyl-2-pyridin-2-yl-pyridin-3-yl)oxy-N-(3,4,5-trimethoxy-phenyl)pyridin-2-amine
CID 44521014
4-[(2,6-dimethyl-3-pyridinyl)oxy]-N-(3,4,5-trimethoxyphenyl)pyridin-2-amine
CID 44521015
Acetamide, N-[3-[6-[(3,4,5-trimethoxyphenyl)amino]pyrazinyl]phenyl]-
CID 11682654
6-(pyridin-4-yl)-N-(3,4,5-trimethoxyphenyl)pyrazin-2-amine
CID 24879140
1-Phenyl-3-(4-{6-[(3,4,5-trimethoxyphenyl)amino]pyrazin-2-yl}phenyl)urea
CID 24879141

Frequently Asked Questions

What is the IUPAC name of 6-pyridin-3-yloxy-N-(3,4,5-trimethoxyphenyl)pyrazin-2-amine?
The IUPAC name of 6-pyridin-3-yloxy-N-(3,4,5-trimethoxyphenyl)pyrazin-2-amine (CID 24879206) is 6-pyridin-3-yloxy-N-(3,4,5-trimethoxyphenyl)pyrazin-2-amine.
What is the SMILES notation for 6-pyridin-3-yloxy-N-(3,4,5-trimethoxyphenyl)pyrazin-2-amine?
The canonical SMILES for 6-pyridin-3-yloxy-N-(3,4,5-trimethoxyphenyl)pyrazin-2-amine is COc1cc(Nc2cncc(Oc3cccnc3)n2)cc(OC)c1OC.
What is the InChIKey of 6-pyridin-3-yloxy-N-(3,4,5-trimethoxyphenyl)pyrazin-2-amine?
The InChIKey is OVLFURDMHZJLCV-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N4O4/c1-23-14-7-12(8-15(24-2)18(14)25-3)21-16-10-20-11-17(22-16)26-13-5-4-6-19-9-13/h4-11H,1-3H3,(H,21,22).
What are the key properties of 6-pyridin-3-yloxy-N-(3,4,5-trimethoxyphenyl)pyrazin-2-amine?
6-pyridin-3-yloxy-N-(3,4,5-trimethoxyphenyl)pyrazin-2-amine has a molecular weight of 354.37 g/mol, XLogP of 3.43, 7 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 6-pyridin-3-yloxy-N-(3,4,5-trimethoxyphenyl)pyrazin-2-amine is sourced from PubChem (CID 24879206), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).