6-(1-methylpyrazol-4-yl)-3-(4-phenoxyphenyl)imidazo[1,2-a]pyrazine

C22H17N5O — CID 126672977

IUPAC6-(1-methylpyrazol-4-yl)-3-(4-phenoxyphenyl)imidazo[1,2-a]pyrazine
SMILESCn1cc(-c2cn3c(-c4ccc(Oc5ccccc5)cc4)cnc3cn2)cn1
InChIInChI=1S/C22H17N5O/c1-26-14-17(11-25-26)20-15-27-21(12-24-22(27)13-23-20)16-7-9-19(10-8-16)28-18-5-3-2-4-6-18/h2-15H,1H3
InChIKeySDFFEAIGKNGJGT-UHFFFAOYSA-N
MW367.41 g/mol
LogP4.59
Rot. Bonds4

About 6-(1-methylpyrazol-4-yl)-3-(4-phenoxyphenyl)imidazo[1,2-a]pyrazine

6-(1-methylpyrazol-4-yl)-3-(4-phenoxyphenyl)imidazo[1,2-a]pyrazine (PubChem CID 126672977) has the molecular formula C22H17N5O and a molecular weight of 367.41 g/mol. Its IUPAC name is 6-(1-methylpyrazol-4-yl)-3-(4-phenoxyphenyl)imidazo[1,2-a]pyrazine.

Molecular Properties

Compound Name6-(1-methylpyrazol-4-yl)-3-(4-phenoxyphenyl)imidazo[1,2-a]pyrazine
PubChem CID126672977
Molecular FormulaC22H17N5O
Molecular Weight367.41 g/mol
Exact Mass367.14
IUPAC Name6-(1-methylpyrazol-4-yl)-3-(4-phenoxyphenyl)imidazo[1,2-a]pyrazine
SMILESCn1cc(-c2cn3c(-c4ccc(Oc5ccccc5)cc4)cnc3cn2)cn1
InChIInChI=1S/C22H17N5O/c1-26-14-17(11-25-26)20-15-27-21(12-24-22(27)13-23-20)16-7-9-19(10-8-16)28-18-5-3-2-4-6-18/h2-15H,1H3
InChIKeySDFFEAIGKNGJGT-UHFFFAOYSA-N
XLogP4.59
TPSA57.24 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.41
LogP ≤ 54.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 6-(1-methylpyrazol-4-yl)-3-(4-phenoxyphenyl)imidazo[1,2-a]pyrazine?
The IUPAC name of 6-(1-methylpyrazol-4-yl)-3-(4-phenoxyphenyl)imidazo[1,2-a]pyrazine (CID 126672977) is 6-(1-methylpyrazol-4-yl)-3-(4-phenoxyphenyl)imidazo[1,2-a]pyrazine.
What is the SMILES notation for 6-(1-methylpyrazol-4-yl)-3-(4-phenoxyphenyl)imidazo[1,2-a]pyrazine?
The canonical SMILES for 6-(1-methylpyrazol-4-yl)-3-(4-phenoxyphenyl)imidazo[1,2-a]pyrazine is Cn1cc(-c2cn3c(-c4ccc(Oc5ccccc5)cc4)cnc3cn2)cn1.
What is the InChIKey of 6-(1-methylpyrazol-4-yl)-3-(4-phenoxyphenyl)imidazo[1,2-a]pyrazine?
The InChIKey is SDFFEAIGKNGJGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H17N5O/c1-26-14-17(11-25-26)20-15-27-21(12-24-22(27)13-23-20)16-7-9-19(10-8-16)28-18-5-3-2-4-6-18/h2-15H,1H3.
What are the key properties of 6-(1-methylpyrazol-4-yl)-3-(4-phenoxyphenyl)imidazo[1,2-a]pyrazine?
6-(1-methylpyrazol-4-yl)-3-(4-phenoxyphenyl)imidazo[1,2-a]pyrazine has a molecular weight of 367.41 g/mol, XLogP of 4.59, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(1-methylpyrazol-4-yl)-3-(4-phenoxyphenyl)imidazo[1,2-a]pyrazine is sourced from PubChem (CID 126672977), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).