6-N-pyridin-4-yl-2-N-(3,4,5-trimethoxyphenyl)pyrazine-2,6-diamine

C18H19N5O3 — CID 24879390

IUPAC6-N-pyridin-4-yl-2-N-(3,4,5-trimethoxyphenyl)pyrazine-2,6-diamine
SMILESCOc1cc(Nc2cncc(Nc3ccncc3)n2)cc(OC)c1OC
InChIInChI=1S/C18H19N5O3/c1-24-14-8-13(9-15(25-2)18(14)26-3)22-17-11-20-10-16(23-17)21-12-4-6-19-7-5-12/h4-11H,1-3H3,(H2,19,21,22,23)
InChIKeyFWUVOKGKHMWHSU-UHFFFAOYSA-N
MW353.38 g/mol
LogP3.38
Rot. Bonds7

About 6-N-pyridin-4-yl-2-N-(3,4,5-trimethoxyphenyl)pyrazine-2,6-diamine

6-N-pyridin-4-yl-2-N-(3,4,5-trimethoxyphenyl)pyrazine-2,6-diamine (PubChem CID 24879390) has the molecular formula C18H19N5O3 and a molecular weight of 353.38 g/mol. Its IUPAC name is 6-N-pyridin-4-yl-2-N-(3,4,5-trimethoxyphenyl)pyrazine-2,6-diamine.

Molecular Properties

Compound Name6-N-pyridin-4-yl-2-N-(3,4,5-trimethoxyphenyl)pyrazine-2,6-diamine
PubChem CID24879390
Molecular FormulaC18H19N5O3
Molecular Weight353.38 g/mol
Exact Mass353.15
IUPAC Name6-N-pyridin-4-yl-2-N-(3,4,5-trimethoxyphenyl)pyrazine-2,6-diamine
SMILESCOc1cc(Nc2cncc(Nc3ccncc3)n2)cc(OC)c1OC
InChIInChI=1S/C18H19N5O3/c1-24-14-8-13(9-15(25-2)18(14)26-3)22-17-11-20-10-16(23-17)21-12-4-6-19-7-5-12/h4-11H,1-3H3,(H2,19,21,22,23)
InChIKeyFWUVOKGKHMWHSU-UHFFFAOYSA-N
XLogP3.38
TPSA90.42 Ų
H-Bond Donors2
H-Bond Acceptors8
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.38
LogP ≤ 53.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 108

Analyze 6-N-pyridin-4-yl-2-N-(3,4,5-trimethoxyphenyl)pyrazine-2,6-diamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 6-N-pyridin-4-yl-2-N-(3,4,5-trimethoxyphenyl)pyrazine-2,6-diamine?
The IUPAC name of 6-N-pyridin-4-yl-2-N-(3,4,5-trimethoxyphenyl)pyrazine-2,6-diamine (CID 24879390) is 6-N-pyridin-4-yl-2-N-(3,4,5-trimethoxyphenyl)pyrazine-2,6-diamine.
What is the SMILES notation for 6-N-pyridin-4-yl-2-N-(3,4,5-trimethoxyphenyl)pyrazine-2,6-diamine?
The canonical SMILES for 6-N-pyridin-4-yl-2-N-(3,4,5-trimethoxyphenyl)pyrazine-2,6-diamine is COc1cc(Nc2cncc(Nc3ccncc3)n2)cc(OC)c1OC.
What is the InChIKey of 6-N-pyridin-4-yl-2-N-(3,4,5-trimethoxyphenyl)pyrazine-2,6-diamine?
The InChIKey is FWUVOKGKHMWHSU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N5O3/c1-24-14-8-13(9-15(25-2)18(14)26-3)22-17-11-20-10-16(23-17)21-12-4-6-19-7-5-12/h4-11H,1-3H3,(H2,19,21,22,23).
What are the key properties of 6-N-pyridin-4-yl-2-N-(3,4,5-trimethoxyphenyl)pyrazine-2,6-diamine?
6-N-pyridin-4-yl-2-N-(3,4,5-trimethoxyphenyl)pyrazine-2,6-diamine has a molecular weight of 353.38 g/mol, XLogP of 3.38, 7 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 6-N-pyridin-4-yl-2-N-(3,4,5-trimethoxyphenyl)pyrazine-2,6-diamine is sourced from PubChem (CID 24879390), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).