4-[3-methyl-4-(2-methylimidazo[1,2-a]pyrazin-3-yl)phenoxy]furo[3,2-c]pyridine

C21H16N4O2 — CID 130442590

IUPAC4-[3-methyl-4-(2-methylimidazo[1,2-a]pyrazin-3-yl)phenoxy]furo[3,2-c]pyridine
SMILESCc1cc(Oc2nccc3occc23)ccc1-c1c(C)nc2cnccn12
InChIInChI=1S/C21H16N4O2/c1-13-11-15(27-21-17-6-10-26-18(17)5-7-23-21)3-4-16(13)20-14(2)24-19-12-22-8-9-25(19)20/h3-12H,1-2H3
InChIKeyQKBXFUHRWRJTOQ-UHFFFAOYSA-N
MW356.39 g/mol
LogP4.95
Rot. Bonds3

About 4-[3-methyl-4-(2-methylimidazo[1,2-a]pyrazin-3-yl)phenoxy]furo[3,2-c]pyridine

4-[3-methyl-4-(2-methylimidazo[1,2-a]pyrazin-3-yl)phenoxy]furo[3,2-c]pyridine (PubChem CID 130442590) has the molecular formula C21H16N4O2 and a molecular weight of 356.39 g/mol. Its IUPAC name is 4-[3-methyl-4-(2-methylimidazo[1,2-a]pyrazin-3-yl)phenoxy]furo[3,2-c]pyridine.

Molecular Properties

Compound Name4-[3-methyl-4-(2-methylimidazo[1,2-a]pyrazin-3-yl)phenoxy]furo[3,2-c]pyridine
PubChem CID130442590
Molecular FormulaC21H16N4O2
Molecular Weight356.39 g/mol
Exact Mass356.13
IUPAC Name4-[3-methyl-4-(2-methylimidazo[1,2-a]pyrazin-3-yl)phenoxy]furo[3,2-c]pyridine
SMILESCc1cc(Oc2nccc3occc23)ccc1-c1c(C)nc2cnccn12
InChIInChI=1S/C21H16N4O2/c1-13-11-15(27-21-17-6-10-26-18(17)5-7-23-21)3-4-16(13)20-14(2)24-19-12-22-8-9-25(19)20/h3-12H,1-2H3
InChIKeyQKBXFUHRWRJTOQ-UHFFFAOYSA-N
XLogP4.95
TPSA65.45 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.39
LogP ≤ 54.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 4-[3-methyl-4-(2-methylimidazo[1,2-a]pyrazin-3-yl)phenoxy]furo[3,2-c]pyridine?
The IUPAC name of 4-[3-methyl-4-(2-methylimidazo[1,2-a]pyrazin-3-yl)phenoxy]furo[3,2-c]pyridine (CID 130442590) is 4-[3-methyl-4-(2-methylimidazo[1,2-a]pyrazin-3-yl)phenoxy]furo[3,2-c]pyridine.
What is the SMILES notation for 4-[3-methyl-4-(2-methylimidazo[1,2-a]pyrazin-3-yl)phenoxy]furo[3,2-c]pyridine?
The canonical SMILES for 4-[3-methyl-4-(2-methylimidazo[1,2-a]pyrazin-3-yl)phenoxy]furo[3,2-c]pyridine is Cc1cc(Oc2nccc3occc23)ccc1-c1c(C)nc2cnccn12.
What is the InChIKey of 4-[3-methyl-4-(2-methylimidazo[1,2-a]pyrazin-3-yl)phenoxy]furo[3,2-c]pyridine?
The InChIKey is QKBXFUHRWRJTOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H16N4O2/c1-13-11-15(27-21-17-6-10-26-18(17)5-7-23-21)3-4-16(13)20-14(2)24-19-12-22-8-9-25(19)20/h3-12H,1-2H3.
What are the key properties of 4-[3-methyl-4-(2-methylimidazo[1,2-a]pyrazin-3-yl)phenoxy]furo[3,2-c]pyridine?
4-[3-methyl-4-(2-methylimidazo[1,2-a]pyrazin-3-yl)phenoxy]furo[3,2-c]pyridine has a molecular weight of 356.39 g/mol, XLogP of 4.95, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[3-methyl-4-(2-methylimidazo[1,2-a]pyrazin-3-yl)phenoxy]furo[3,2-c]pyridine is sourced from PubChem (CID 130442590), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).