4-[3-(imidazo[1,2-a]pyridin-6-ylmethyl)triazolo[4,5-b]pyrazin-5-yl]morpholine

C16H16N8O — CID 53262468

IUPAC4-[3-(imidazo[1,2-a]pyridin-6-ylmethyl)triazolo[4,5-b]pyrazin-5-yl]morpholine
SMILESc1cn2cc(Cn3nnc4ncc(N5CCOCC5)nc43)ccc2n1
InChIInChI=1S/C16H16N8O/c1-2-13-17-3-4-23(13)10-12(1)11-24-16-15(20-21-24)18-9-14(19-16)22-5-7-25-8-6-22/h1-4,9-10H,5-8,11H2
InChIKeyFOAJIFMQJFGRJZ-UHFFFAOYSA-N
MW336.36 g/mol
LogP0.75
Rot. Bonds3

About 4-[3-(imidazo[1,2-a]pyridin-6-ylmethyl)triazolo[4,5-b]pyrazin-5-yl]morpholine

4-[3-(imidazo[1,2-a]pyridin-6-ylmethyl)triazolo[4,5-b]pyrazin-5-yl]morpholine (PubChem CID 53262468) has the molecular formula C16H16N8O and a molecular weight of 336.36 g/mol. Its IUPAC name is 4-[3-(imidazo[1,2-a]pyridin-6-ylmethyl)triazolo[4,5-b]pyrazin-5-yl]morpholine.

Molecular Properties

Compound Name4-[3-(imidazo[1,2-a]pyridin-6-ylmethyl)triazolo[4,5-b]pyrazin-5-yl]morpholine
PubChem CID53262468
Molecular FormulaC16H16N8O
Molecular Weight336.36 g/mol
Exact Mass336.14
IUPAC Name4-[3-(imidazo[1,2-a]pyridin-6-ylmethyl)triazolo[4,5-b]pyrazin-5-yl]morpholine
SMILESc1cn2cc(Cn3nnc4ncc(N5CCOCC5)nc43)ccc2n1
InChIInChI=1S/C16H16N8O/c1-2-13-17-3-4-23(13)10-12(1)11-24-16-15(20-21-24)18-9-14(19-16)22-5-7-25-8-6-22/h1-4,9-10H,5-8,11H2
InChIKeyFOAJIFMQJFGRJZ-UHFFFAOYSA-N
XLogP0.75
TPSA86.26 Ų
H-Bond Donors
H-Bond Acceptors9
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.36
LogP ≤ 50.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 109

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Frequently Asked Questions

What is the IUPAC name of 4-[3-(imidazo[1,2-a]pyridin-6-ylmethyl)triazolo[4,5-b]pyrazin-5-yl]morpholine?
The IUPAC name of 4-[3-(imidazo[1,2-a]pyridin-6-ylmethyl)triazolo[4,5-b]pyrazin-5-yl]morpholine (CID 53262468) is 4-[3-(imidazo[1,2-a]pyridin-6-ylmethyl)triazolo[4,5-b]pyrazin-5-yl]morpholine.
What is the SMILES notation for 4-[3-(imidazo[1,2-a]pyridin-6-ylmethyl)triazolo[4,5-b]pyrazin-5-yl]morpholine?
The canonical SMILES for 4-[3-(imidazo[1,2-a]pyridin-6-ylmethyl)triazolo[4,5-b]pyrazin-5-yl]morpholine is c1cn2cc(Cn3nnc4ncc(N5CCOCC5)nc43)ccc2n1.
What is the InChIKey of 4-[3-(imidazo[1,2-a]pyridin-6-ylmethyl)triazolo[4,5-b]pyrazin-5-yl]morpholine?
The InChIKey is FOAJIFMQJFGRJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N8O/c1-2-13-17-3-4-23(13)10-12(1)11-24-16-15(20-21-24)18-9-14(19-16)22-5-7-25-8-6-22/h1-4,9-10H,5-8,11H2.
What are the key properties of 4-[3-(imidazo[1,2-a]pyridin-6-ylmethyl)triazolo[4,5-b]pyrazin-5-yl]morpholine?
4-[3-(imidazo[1,2-a]pyridin-6-ylmethyl)triazolo[4,5-b]pyrazin-5-yl]morpholine has a molecular weight of 336.36 g/mol, XLogP of 0.75, 3 rotatable bonds, 0 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[3-(imidazo[1,2-a]pyridin-6-ylmethyl)triazolo[4,5-b]pyrazin-5-yl]morpholine is sourced from PubChem (CID 53262468), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).