2-[2-(6-ethoxy-2-pyridinyl)imidazo[4,5-b]pyrazin-3-yl]-3-methoxyphenol

C19H15N5O3 — CID 167034462

IUPAC2-[2-(6-ethoxy-2-pyridinyl)imidazo[4,5-b]pyrazin-3-yl]-3-methoxyphenol
SMILESCCOC1=NC(c2nc3nccnc3n2-c2c(O)cccc2OC)=C=C=C1
InChIInChI=1S/C19H15N5O3/c1-3-27-15-9-4-6-12(22-15)18-23-17-19(21-11-10-20-17)24(18)16-13(25)7-5-8-14(16)26-2/h5,7-11,25H,3H2,1-2H3
InChIKeyGVLHHXACSAHBKW-UHFFFAOYSA-N
MW361.36 g/mol
LogP2.63
Rot. Bonds4

About 2-[2-(6-ethoxy-2-pyridinyl)imidazo[4,5-b]pyrazin-3-yl]-3-methoxyphenol

2-[2-(6-ethoxy-2-pyridinyl)imidazo[4,5-b]pyrazin-3-yl]-3-methoxyphenol (PubChem CID 167034462) has the molecular formula C19H15N5O3 and a molecular weight of 361.36 g/mol. Its IUPAC name is 2-[2-(6-ethoxy-2-pyridinyl)imidazo[4,5-b]pyrazin-3-yl]-3-methoxyphenol.

Molecular Properties

Compound Name2-[2-(6-ethoxy-2-pyridinyl)imidazo[4,5-b]pyrazin-3-yl]-3-methoxyphenol
PubChem CID167034462
Molecular FormulaC19H15N5O3
Molecular Weight361.36 g/mol
Exact Mass361.12
IUPAC Name2-[2-(6-ethoxy-2-pyridinyl)imidazo[4,5-b]pyrazin-3-yl]-3-methoxyphenol
SMILESCCOC1=NC(c2nc3nccnc3n2-c2c(O)cccc2OC)=C=C=C1
InChIInChI=1S/C19H15N5O3/c1-3-27-15-9-4-6-12(22-15)18-23-17-19(21-11-10-20-17)24(18)16-13(25)7-5-8-14(16)26-2/h5,7-11,25H,3H2,1-2H3
InChIKeyGVLHHXACSAHBKW-UHFFFAOYSA-N
XLogP2.63
TPSA94.65 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500361.36
LogP ≤ 52.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

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Frequently Asked Questions

What is the IUPAC name of 2-[2-(6-ethoxy-2-pyridinyl)imidazo[4,5-b]pyrazin-3-yl]-3-methoxyphenol?
The IUPAC name of 2-[2-(6-ethoxy-2-pyridinyl)imidazo[4,5-b]pyrazin-3-yl]-3-methoxyphenol (CID 167034462) is 2-[2-(6-ethoxy-2-pyridinyl)imidazo[4,5-b]pyrazin-3-yl]-3-methoxyphenol.
What is the SMILES notation for 2-[2-(6-ethoxy-2-pyridinyl)imidazo[4,5-b]pyrazin-3-yl]-3-methoxyphenol?
The canonical SMILES for 2-[2-(6-ethoxy-2-pyridinyl)imidazo[4,5-b]pyrazin-3-yl]-3-methoxyphenol is CCOC1=NC(c2nc3nccnc3n2-c2c(O)cccc2OC)=C=C=C1.
What is the InChIKey of 2-[2-(6-ethoxy-2-pyridinyl)imidazo[4,5-b]pyrazin-3-yl]-3-methoxyphenol?
The InChIKey is GVLHHXACSAHBKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15N5O3/c1-3-27-15-9-4-6-12(22-15)18-23-17-19(21-11-10-20-17)24(18)16-13(25)7-5-8-14(16)26-2/h5,7-11,25H,3H2,1-2H3.
What are the key properties of 2-[2-(6-ethoxy-2-pyridinyl)imidazo[4,5-b]pyrazin-3-yl]-3-methoxyphenol?
2-[2-(6-ethoxy-2-pyridinyl)imidazo[4,5-b]pyrazin-3-yl]-3-methoxyphenol has a molecular weight of 361.36 g/mol, XLogP of 2.63, 4 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(6-ethoxy-2-pyridinyl)imidazo[4,5-b]pyrazin-3-yl]-3-methoxyphenol is sourced from PubChem (CID 167034462), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).