3-(oxolan-3-yl)-1-(3-phenylmethoxyphenyl)imidazo[1,5-a]pyrazine

C23H21N3O2 — CID 141117026

IUPAC3-(oxolan-3-yl)-1-(3-phenylmethoxyphenyl)imidazo[1,5-a]pyrazine
SMILESc1ccc(COc2cccc(-c3nc(C4CCOC4)n4ccncc34)c2)cc1
InChIInChI=1S/C23H21N3O2/c1-2-5-17(6-3-1)15-28-20-8-4-7-18(13-20)22-21-14-24-10-11-26(21)23(25-22)19-9-12-27-16-19/h1-8,10-11,13-14,19H,9,12,15-16H2
InChIKeyVJEAKWGDJQLZKU-UHFFFAOYSA-N
MW371.44 g/mol
LogP4.48
Rot. Bonds5

About 3-(oxolan-3-yl)-1-(3-phenylmethoxyphenyl)imidazo[1,5-a]pyrazine

3-(oxolan-3-yl)-1-(3-phenylmethoxyphenyl)imidazo[1,5-a]pyrazine (PubChem CID 141117026) has the molecular formula C23H21N3O2 and a molecular weight of 371.44 g/mol. Its IUPAC name is 3-(oxolan-3-yl)-1-(3-phenylmethoxyphenyl)imidazo[1,5-a]pyrazine.

Molecular Properties

Compound Name3-(oxolan-3-yl)-1-(3-phenylmethoxyphenyl)imidazo[1,5-a]pyrazine
PubChem CID141117026
Molecular FormulaC23H21N3O2
Molecular Weight371.44 g/mol
Exact Mass371.16
IUPAC Name3-(oxolan-3-yl)-1-(3-phenylmethoxyphenyl)imidazo[1,5-a]pyrazine
SMILESc1ccc(COc2cccc(-c3nc(C4CCOC4)n4ccncc34)c2)cc1
InChIInChI=1S/C23H21N3O2/c1-2-5-17(6-3-1)15-28-20-8-4-7-18(13-20)22-21-14-24-10-11-26(21)23(25-22)19-9-12-27-16-19/h1-8,10-11,13-14,19H,9,12,15-16H2
InChIKeyVJEAKWGDJQLZKU-UHFFFAOYSA-N
XLogP4.48
TPSA48.65 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.44
LogP ≤ 54.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

3-(4-methoxycyclohexyl)-1-(3-phenylmethoxyphenyl)imidazo[1,5-a]pyrazine
CID 141117028
8-chloro-3-(1-methylpiperidin-4-yl)-1-(3-phenylmethoxyphenyl)imidazo[1,5-a]pyrazine
CID 59852763
3-[8-chloro-1-(3-phenylmethoxyphenyl)imidazo[1,5-a]pyrazin-3-yl]cyclobutan-1-one
CID 59852819
3-cyclobutyl-N,N-diethyl-1-(3-phenylmethoxyphenyl)imidazo[1,5-a]pyrazin-8-amine
CID 67417761
3-cyclobutyl-N-(2-methoxyethyl)-1-(3-phenylmethoxyphenyl)imidazo[1,5-a]pyrazin-8-amine
CID 67415806
3-[3-(2,5-dihydropyrrol-1-ylmethyl)cyclobutyl]-1-(3-phenylmethoxyphenyl)imidazo[1,5-a]pyrazin-8-amine
CID 67417957
3-[3-(anilinomethyl)cyclobutyl]-1-(3-phenylmethoxyphenyl)imidazo[1,5-a]pyrazin-8-amine
CID 67416861
methyl 3-[8-chloro-1-(3-phenylmethoxyphenyl)imidazo[1,5-a]pyrazin-3-yl]cyclobutane-1-carboxylate
CID 59852728
N-[[4-[8-amino-1-(3-phenylmethoxyphenyl)imidazo[1,5-a]pyrazin-3-yl]cyclohexyl]methyl]acetamide
CID 11213548
2-[[4-[8-amino-1-(3-phenylmethoxyphenyl)imidazo[1,5-a]pyrazin-3-yl]cyclohexyl]methyl]isoindole-1,3-dione
CID 11376357
8-(3-phenylmethoxyphenyl)imidazo[1,5-a]pyridine
CID 25013106
trans-(1R,2R)-2-[8-amino-1-(3-phenylmethoxyphenyl)imidazo[1,5-a]pyrazin-3-yl]cyclobutane-1-carboxamide
CID 142682586

Frequently Asked Questions

What is the IUPAC name of 3-(oxolan-3-yl)-1-(3-phenylmethoxyphenyl)imidazo[1,5-a]pyrazine?
The IUPAC name of 3-(oxolan-3-yl)-1-(3-phenylmethoxyphenyl)imidazo[1,5-a]pyrazine (CID 141117026) is 3-(oxolan-3-yl)-1-(3-phenylmethoxyphenyl)imidazo[1,5-a]pyrazine.
What is the SMILES notation for 3-(oxolan-3-yl)-1-(3-phenylmethoxyphenyl)imidazo[1,5-a]pyrazine?
The canonical SMILES for 3-(oxolan-3-yl)-1-(3-phenylmethoxyphenyl)imidazo[1,5-a]pyrazine is c1ccc(COc2cccc(-c3nc(C4CCOC4)n4ccncc34)c2)cc1.
What is the InChIKey of 3-(oxolan-3-yl)-1-(3-phenylmethoxyphenyl)imidazo[1,5-a]pyrazine?
The InChIKey is VJEAKWGDJQLZKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H21N3O2/c1-2-5-17(6-3-1)15-28-20-8-4-7-18(13-20)22-21-14-24-10-11-26(21)23(25-22)19-9-12-27-16-19/h1-8,10-11,13-14,19H,9,12,15-16H2.
What are the key properties of 3-(oxolan-3-yl)-1-(3-phenylmethoxyphenyl)imidazo[1,5-a]pyrazine?
3-(oxolan-3-yl)-1-(3-phenylmethoxyphenyl)imidazo[1,5-a]pyrazine has a molecular weight of 371.44 g/mol, XLogP of 4.48, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(oxolan-3-yl)-1-(3-phenylmethoxyphenyl)imidazo[1,5-a]pyrazine is sourced from PubChem (CID 141117026), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).