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

C20H15N5O — CID 162650816

IUPAC4-[6-(1-methylindazol-4-yl)imidazo[1,2-a]pyrazin-3-yl]phenol
SMILESCn1ncc2c(-c3cn4c(-c5ccc(O)cc5)cnc4cn3)cccc21
InChIInChI=1S/C20H15N5O/c1-24-18-4-2-3-15(16(18)9-23-24)17-12-25-19(10-22-20(25)11-21-17)13-5-7-14(26)8-6-13/h2-12,26H,1H3
InChIKeyBBGYIKQURGPFRO-UHFFFAOYSA-N
MW341.37 g/mol
LogP3.66
Rot. Bonds2

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

4-[6-(1-methylindazol-4-yl)imidazo[1,2-a]pyrazin-3-yl]phenol (PubChem CID 162650816) has the molecular formula C20H15N5O and a molecular weight of 341.37 g/mol. Its IUPAC name is 4-[6-(1-methylindazol-4-yl)imidazo[1,2-a]pyrazin-3-yl]phenol.

Molecular Properties

Compound Name4-[6-(1-methylindazol-4-yl)imidazo[1,2-a]pyrazin-3-yl]phenol
PubChem CID162650816
Molecular FormulaC20H15N5O
Molecular Weight341.37 g/mol
Exact Mass341.13
IUPAC Name4-[6-(1-methylindazol-4-yl)imidazo[1,2-a]pyrazin-3-yl]phenol
SMILESCn1ncc2c(-c3cn4c(-c5ccc(O)cc5)cnc4cn3)cccc21
InChIInChI=1S/C20H15N5O/c1-24-18-4-2-3-15(16(18)9-23-24)17-12-25-19(10-22-20(25)11-21-17)13-5-7-14(26)8-6-13/h2-12,26H,1H3
InChIKeyBBGYIKQURGPFRO-UHFFFAOYSA-N
XLogP3.66
TPSA68.24 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.37
LogP ≤ 53.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 4-[6-(1-methylindazol-4-yl)imidazo[1,2-a]pyrazin-3-yl]phenol?
The IUPAC name of 4-[6-(1-methylindazol-4-yl)imidazo[1,2-a]pyrazin-3-yl]phenol (CID 162650816) is 4-[6-(1-methylindazol-4-yl)imidazo[1,2-a]pyrazin-3-yl]phenol.
What is the SMILES notation for 4-[6-(1-methylindazol-4-yl)imidazo[1,2-a]pyrazin-3-yl]phenol?
The canonical SMILES for 4-[6-(1-methylindazol-4-yl)imidazo[1,2-a]pyrazin-3-yl]phenol is Cn1ncc2c(-c3cn4c(-c5ccc(O)cc5)cnc4cn3)cccc21.
What is the InChIKey of 4-[6-(1-methylindazol-4-yl)imidazo[1,2-a]pyrazin-3-yl]phenol?
The InChIKey is BBGYIKQURGPFRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H15N5O/c1-24-18-4-2-3-15(16(18)9-23-24)17-12-25-19(10-22-20(25)11-21-17)13-5-7-14(26)8-6-13/h2-12,26H,1H3.
What are the key properties of 4-[6-(1-methylindazol-4-yl)imidazo[1,2-a]pyrazin-3-yl]phenol?
4-[6-(1-methylindazol-4-yl)imidazo[1,2-a]pyrazin-3-yl]phenol has a molecular weight of 341.37 g/mol, XLogP of 3.66, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[6-(1-methylindazol-4-yl)imidazo[1,2-a]pyrazin-3-yl]phenol is sourced from PubChem (CID 162650816), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).