4-[6-(6-amino-3-pyridinyl)imidazo[1,2-a]pyrazin-3-yl]phenol

C17H13N5O — CID 137120126

IUPAC4-[6-(6-amino-3-pyridinyl)imidazo[1,2-a]pyrazin-3-yl]phenol
SMILESNc1ccc(-c2cn3c(-c4ccc(O)cc4)cnc3cn2)cn1
InChIInChI=1S/C17H13N5O/c18-16-6-3-12(7-20-16)14-10-22-15(8-21-17(22)9-19-14)11-1-4-13(23)5-2-11/h1-10,23H,(H2,18,20)
InChIKeyQYGDMXTZOLOJPL-UHFFFAOYSA-N
MW303.33 g/mol
LogP2.75
Rot. Bonds2

About 4-[6-(6-amino-3-pyridinyl)imidazo[1,2-a]pyrazin-3-yl]phenol

4-[6-(6-amino-3-pyridinyl)imidazo[1,2-a]pyrazin-3-yl]phenol (PubChem CID 137120126) has the molecular formula C17H13N5O and a molecular weight of 303.33 g/mol. Its IUPAC name is 4-[6-(6-amino-3-pyridinyl)imidazo[1,2-a]pyrazin-3-yl]phenol.

Molecular Properties

Compound Name4-[6-(6-amino-3-pyridinyl)imidazo[1,2-a]pyrazin-3-yl]phenol
PubChem CID137120126
Molecular FormulaC17H13N5O
Molecular Weight303.33 g/mol
Exact Mass303.11
IUPAC Name4-[6-(6-amino-3-pyridinyl)imidazo[1,2-a]pyrazin-3-yl]phenol
SMILESNc1ccc(-c2cn3c(-c4ccc(O)cc4)cnc3cn2)cn1
InChIInChI=1S/C17H13N5O/c18-16-6-3-12(7-20-16)14-10-22-15(8-21-17(22)9-19-14)11-1-4-13(23)5-2-11/h1-10,23H,(H2,18,20)
InChIKeyQYGDMXTZOLOJPL-UHFFFAOYSA-N
XLogP2.75
TPSA89.33 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.33
LogP ≤ 52.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 4-[6-(6-amino-3-pyridinyl)imidazo[1,2-a]pyrazin-3-yl]phenol?
The IUPAC name of 4-[6-(6-amino-3-pyridinyl)imidazo[1,2-a]pyrazin-3-yl]phenol (CID 137120126) is 4-[6-(6-amino-3-pyridinyl)imidazo[1,2-a]pyrazin-3-yl]phenol.
What is the SMILES notation for 4-[6-(6-amino-3-pyridinyl)imidazo[1,2-a]pyrazin-3-yl]phenol?
The canonical SMILES for 4-[6-(6-amino-3-pyridinyl)imidazo[1,2-a]pyrazin-3-yl]phenol is Nc1ccc(-c2cn3c(-c4ccc(O)cc4)cnc3cn2)cn1.
What is the InChIKey of 4-[6-(6-amino-3-pyridinyl)imidazo[1,2-a]pyrazin-3-yl]phenol?
The InChIKey is QYGDMXTZOLOJPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H13N5O/c18-16-6-3-12(7-20-16)14-10-22-15(8-21-17(22)9-19-14)11-1-4-13(23)5-2-11/h1-10,23H,(H2,18,20).
What are the key properties of 4-[6-(6-amino-3-pyridinyl)imidazo[1,2-a]pyrazin-3-yl]phenol?
4-[6-(6-amino-3-pyridinyl)imidazo[1,2-a]pyrazin-3-yl]phenol has a molecular weight of 303.33 g/mol, XLogP of 2.75, 2 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[6-(6-amino-3-pyridinyl)imidazo[1,2-a]pyrazin-3-yl]phenol is sourced from PubChem (CID 137120126), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).