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

C17H15N5O2 — CID 137001345

IUPAC2-methoxy-4-[6-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-3-yl]phenol
SMILESCOc1cc(-c2cnc3cnc(-c4cnn(C)c4)cn23)ccc1O
InChIInChI=1S/C17H15N5O2/c1-21-9-12(6-20-21)13-10-22-14(7-19-17(22)8-18-13)11-3-4-15(23)16(5-11)24-2/h3-10,23H,1-2H3
InChIKeyCOCWUAGXJWMRIR-UHFFFAOYSA-N
MW321.34 g/mol
LogP2.51
Rot. Bonds3

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

2-methoxy-4-[6-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-3-yl]phenol (PubChem CID 137001345) has the molecular formula C17H15N5O2 and a molecular weight of 321.34 g/mol. Its IUPAC name is 2-methoxy-4-[6-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-3-yl]phenol.

Molecular Properties

Compound Name2-methoxy-4-[6-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-3-yl]phenol
PubChem CID137001345
Molecular FormulaC17H15N5O2
Molecular Weight321.34 g/mol
Exact Mass321.12
IUPAC Name2-methoxy-4-[6-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-3-yl]phenol
SMILESCOc1cc(-c2cnc3cnc(-c4cnn(C)c4)cn23)ccc1O
InChIInChI=1S/C17H15N5O2/c1-21-9-12(6-20-21)13-10-22-14(7-19-17(22)8-18-13)11-3-4-15(23)16(5-11)24-2/h3-10,23H,1-2H3
InChIKeyCOCWUAGXJWMRIR-UHFFFAOYSA-N
XLogP2.51
TPSA77.47 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.34
LogP ≤ 52.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 2-methoxy-4-[6-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-3-yl]phenol?
The IUPAC name of 2-methoxy-4-[6-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-3-yl]phenol (CID 137001345) is 2-methoxy-4-[6-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-3-yl]phenol.
What is the SMILES notation for 2-methoxy-4-[6-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-3-yl]phenol?
The canonical SMILES for 2-methoxy-4-[6-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-3-yl]phenol is COc1cc(-c2cnc3cnc(-c4cnn(C)c4)cn23)ccc1O.
What is the InChIKey of 2-methoxy-4-[6-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-3-yl]phenol?
The InChIKey is COCWUAGXJWMRIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15N5O2/c1-21-9-12(6-20-21)13-10-22-14(7-19-17(22)8-18-13)11-3-4-15(23)16(5-11)24-2/h3-10,23H,1-2H3.
What are the key properties of 2-methoxy-4-[6-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-3-yl]phenol?
2-methoxy-4-[6-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-3-yl]phenol has a molecular weight of 321.34 g/mol, XLogP of 2.51, 3 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-4-[6-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-3-yl]phenol is sourced from PubChem (CID 137001345), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).